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| CAS Number | 65141-46-0 |
| Catalog Number | AG003T3N(AGN-PC-050KZZ) |
| Chemical Name | Nicorandil |
| EC Number | 265-514-1 |
| IUPAC Name | 2-(pyridine-3-carbonylamino)ethyl nitrate |
| InChI | InChI=1S/C8H9N3O4/c12-8(7-2-1-3-9-6-7)10-4-5-15-11(13)14/h1-3,6H,4-5H2,(H,10,12) |
| InChI Key | LBHIOVVIQHSOQN-UHFFFAOYSA-N |
| MDL Number | MFCD00186520 |
| Molecular Formula | C8H9N3O4 |
| Molecular Weight | 211.1748 |
| SMILES | O=C(C1=CC=CN=C1)NCCO[N+]([O-])=O |
| UNII | 260456HAM0 |
| Synonyms | 2 Nicotinamidethyl Nitrate,
2 Nicotinamidoethyl Nitrate,
2-Nicotinamidethyl Nitrate,
2-Nicotinamidoethyl Nitrate,
Adancor,
Dancor,
Ikorel,
Nicorandil,
Nitrate, 2-Nicotinamidethyl,
Nitrate, 2-Nicotinamidoethyl,
SG 75,
SG-75,
SG75,
NICORANDIL,
65141-46-0,
Ikorel,
Dancor,
2-Nicotinamidoethyl nitrate,
SG-75,
Nicorandilum,
Adancor,
Sigmart,
SG 75,
2-(nicotinamido)ethyl nitrate,
N-(2-Hydroxyethyl)nicotinamide nitrate,
Nicorandilum [INN-Latin],
2-(pyridine-3-carbonylamino)ethyl nitrate,
2-(Nicotinamido)ethyl nitrat,
Nikoran,
Nitorubin,
Aprior,
N-(2-Hydroxyethyl)nicotinamide nitrate (ester),
BRN 0481451,
Nicorandil (Ikorel),
UNII-260456HAM0,
EINECS 265-514-1,
N-[2-(NITROOXY)ETHYL]-3-PYRIDINECARBOXAMIDE,
CHEBI:31905,
3-Pyridinecarboxamide, N-(2-(nitroxy)ethyl)-,
MFCD00186520,
3-PYRIDINECARBOXAMIDE, N-[2-(NITROOXY)ETHYL]-,
260456HAM0,
NCGC00025357-01,
CPD000466365,
n-(2-hydroxyethyl)nicotinamide nitrate ester,
3-Pyridinecarboxamide, N-(2-(nitrooxy)ethyl)-,
DSSTox_CID_25692,
DSSTox_RID_81064,
DSSTox_GSID_45692,
2-[(PYRIDIN-3-YLCARBONYL)AMINO]ETHYL NITRATE,
2-Nicotinamidethyl Nitrate,
SMR000466365,
Sigmart (TN),
CAS-65141-46-0,
PERISALOL,
N-[2-(nitrooxy)ethyl]-3-pyridylcarboxamide,
Nicorandil [USAN:BAN:INN:JAN],
SR-01000597534,
nikron,
Nicorandil [USAN:INN:BAN:JAN],
Nicorandil(Ikorel),
2-(Pyridine-3-carboxamido)ethyl Nitrate,
RP-46417,
AC1Q5PMV,
2-[(pyridin-3-ylcarbonyl)amino]ethylnitrat,
2-[(3-pyridinylcarbonyl)amino]ethyl nitrate,
N-[2-(Nitrooxy)ethyl]pyridine-3-carboxamide,
AC1L2I8U,
SCHEMBL34547,
MLS000759488,
MLS001424162,
MLS002222323,
MLS006010701,
ARONIS24318,
CHEMBL284906,
GTPL2411,
DTXSID8045692,
Nicorandil (JP17/USAN/INN),
BBC/474,
LBHIOVVIQHSOQN-UHFFFAOYSA-N,
ZX-AFC001332,
HMS2051N16,
HMS2089L12,
HMS2095E14,
HMS2232A06,
HMS3268L19,
HMS3371N18,
HMS3393N16,
HMS3655P05,
HMS3677G17,
HMS3712E14,
BCP09434,
HY-B0341,
KS-00000UH3,
ZINC1533102,
ZX-AS004678,
Tox21_110968,
BG0267,
s1971,
SBB080749,
STL445540,
AKOS001589705,
AKOS015855406,
AKOS025149378,
Tox21_110968_1,
AB04467,
AC-4690,
API0003563,
CCG-101045,
CS-2383,
DB09220,
HS-0049,
MCULE-6145684901,
NC00295,
KS-0000478H,
NCGC00025357-02,
NCGC00025357-04,
AN-11709,
CJ-24272,
H924,
SAM001246701,
SC-12673,
2-(pyridin-3-ylcarbonylamino)ethyl nitrate,
AB0013362,
AB2000397,
LS-130673,
TL8004616,
FT-0602677,
N0837,
ST45054164,
SW197675-3,
C13280,
D01810,
Ikorel;Dancor;Nikoran;Aprior;Nitorubin;Sigmart,
J10427,
AB00639978-08,
AB00639978-09,
AB00639978_10,
AB00639978_11,
A834984,
I06-0032,
SR-01000597534-1,
SR-01000597534-5,
BRD-K97752965-001-01-6,
F0005-2298,
nitric acid 2-[[oxo(3-pyridinyl)methyl]amino]ethyl ester,
Ikorel (TN),
Nicorandil Merck Brand,
2 Nicotinamidethyl Nitrate,
2 Nicotinamidoethyl Nitrate,
Nicorandil Aventis Brand,
Nitrate, 2-Nicotinamidethyl,
Merck Brand of Nicorandil,
Nitrate, 2-Nicotinamidoethyl,
D0O2SR,
Aventis Brand of Nicorandil,
C8H9N3O4,
SG75,
Nicorandil (JP15/USAN/INN),
Aventis Pharma Brand of Nicorandil,
C8-H9-N3-O4,
CID47528,
Merck Lipha Sante Brand of Nicorandil,
CS-O-30681,
Rhone Poulenc Rorer Brand of Nicorandil,
Rhone-Poulenc Rorer Brand of Nicorandil,
B2197,
A10641,
D020108,
Nicorandil, 98%, a potassium channel activator - 250G 250g,
|
| Complexity | 228 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.177g/mol |
| Monoisotopic Mass | 211.059g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 97A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
| Symbol: | |
| Hazard Class | 8 |
| Hazard statements | H302-H318 |
| Packing Group | Ⅲ |
| Precautionary statements | P280-P301+P312+P330-P305+P351+P338+P310 |
| UN Code | UN 1759 |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
| Molecular Weight: | ||
| Quantity: |
| Test: | Result: |

