2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl 2,6-dimethyl-4-(1-methylpyrrol-2-yl)-5-nitro-1,4-dihydropyridine-3-carboxylate

Systemtic Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl 2,6-dimethyl-4-(1-methylpyrrol-2-yl)-5-nitro-1,4-dihydropyridine-3-carboxylate Openeye Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl 2,6-dimethyl-4-(1-methylpyrrol-2-yl)-5-nitro-1,4-dihydropyridine-3-carboxylate CAS Name: 2,6-dimethyl-4-(1-methyl-2-pyrrolyl)-5-nitro-1,4-dihydropyridine-3-carboxylic acid 2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl 2,6-dimethyl-4-(1-methylpyrrol-2-yl)-5-nitro-1,4-dihydropyridine-3-carboxylate Traditional Name: 2,6-dimethyl-4-(1-methylpyrrol-2-yl)-5-nitro-1,4-dihydropyridine-3-carboxylic acid 2-[4-(2-methoxyphenyl)piperazino]ethyl ester Formula: C26H33N5O5 MolecularWeight: 495.57072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CN2C)C(=O)OCCN3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CN2C)C(=O)OCCN3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C26H33N5O5/c1-18-23(24(21-9-7-11-28(21)3)25(31(33)34)19(2)27-18)26(32)36-17-16-29-12-14-30(15-13-29)20-8-5-6-10-22(20)35-4/h5-11,24,27H,12-17H2,1-4H3