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

Systemtic Name: 5-phenylpentyl 5-(diethylcarbamoyl)-2,6-dimethyl-4-(1-methyl-5-nitro-imidazol-2-yl)-1,4-dihydropyridine-3-carboxylate Openeye Name: 5-phenylpentyl 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 5-phenylpentyl ester IUPAC Name: 5-phenylpentyl 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 5-phenylpentyl ester Formula: C28H37N5O5 MolecularWeight: 523.62388

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(NC(=C(C1C2=NC=C(N2C)[N+](=O)[O-])C(=O)OCCCCCC3=CC=CC=C3)C)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(NC(=C(C1C2=NC=C(N2C)[N+](=O)[O-])C(=O)OCCCCCC3=CC=CC=C3)C)C

InChI

InChI=1S/C28H37N5O5/c1-6-32(7-2)27(34)23-19(3)30-20(4)24(25(23)26-29-18-22(31(26)5)33(36)37)28(35)38-17-13-9-12-16-21-14-10-8-11-15-21/h8,10-11,14-15,18,25,30H,6-7,9,12-13,16-17H2,1-5H3