butyl 5-(diethylcarbamoyl)-2,6-dimethyl-4-(1-methyl-5-nitro-imidazol-2-yl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: butyl 5-(diethylcarbamoyl)-2,6-dimethyl-4-(1-methyl-5-nitro-imidazol-2-yl)-1,4-dihydropyridine-3-carboxylate Openeye Name: butyl 5-(diethylcarbamoyl)-2,6-dimethyl-4-(1-methyl-5-nitro-imidazol-2-yl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-[diethylamino(oxo)methyl]-2,6-dimethyl-4-(1-methyl-5-nitro-2-imidazolyl)-1,4-dihydropyridine-3-carboxylic acid butyl ester IUPAC Name: butyl 5-(diethylcarbamoyl)-2,6-dimethyl-4-(1-methyl-5-nitroimidazol-2-yl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-(diethylcarbamoyl)-2,6-dimethyl-4-(1-methyl-5-nitro-imidazol-2-yl)-1,4-dihydropyridine-3-carboxylic acid butyl ester Formula: C21H31N5O5 MolecularWeight: 433.50134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(NC(=C(C1C2=NC=C(N2C)[N+](=O)[O-])C(=O)N(CC)CC)C)C

Isomeric SMILES

CCCCOC(=O)C1=C(NC(=C(C1C2=NC=C(N2C)[N+](=O)[O-])C(=O)N(CC)CC)C)C

InChI

InChI=1S/C21H31N5O5/c1-7-10-11-31-21(28)17-14(5)23-13(4)16(20(27)25(8-2)9-3)18(17)19-22-12-15(24(19)6)26(29)30/h12,18,23H,7-11H2,1-6H3