6-methyl-4-(3-nitrophenyl)-3-(phenylsulfonyl)-1-piperidin-1-yl-3,4-dihydro-2H-pyridine-5-carboxylic acid

Systemtic Name: 6-methyl-4-(3-nitrophenyl)-3-(phenylsulfonyl)-1-piperidin-1-yl-3,4-dihydro-2H-pyridine-5-carboxylic acid Openeye Name: 3-(benzenesulfonyl)-6-methyl-4-(3-nitrophenyl)-1-(1-piperidyl)-3,4-dihydro-2H-pyridine-5-carboxylic acid CAS Name: 3-(benzenesulfonyl)-6-methyl-4-(3-nitrophenyl)-1-(1-piperidinyl)-3,4-dihydro-2H-pyridine-5-carboxylic acid IUPAC Name: 3-(benzenesulfonyl)-6-methyl-4-(3-nitrophenyl)-1-piperidin-1-yl-3,4-dihydro-2H-pyridine-5-carboxylic acid Traditional Name: 3-besyl-6-methyl-4-(3-nitrophenyl)-1-piperidino-3,4-dihydro-2H-pyridine-5-carboxylic acid Formula: C24H27N3O6S MolecularWeight: 485.55268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(CN1N2CCCCC2)S(=O)(=O)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C(C(CN1N2CCCCC2)S(=O)(=O)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C24H27N3O6S/c1-17-22(24(28)29)23(18-9-8-10-19(15-18)27(30)31)21(16-26(17)25-13-6-3-7-14-25)34(32,33)20-11-4-2-5-12-20/h2,4-5,8-12,15,21,23H,3,6-7,13-14,16H2,1H3,(H,28,29)