O3-methyl O5-[1-(phenylmethyl)piperidin-4-yl] 2,6-dimethyl-4-(3-nitrophenyl)-1-oxidanyl-4H-pyridine-3,5-dicarboxylate

Systemtic Name: O3-methyl O5-[1-(phenylmethyl)piperidin-4-yl] 2,6-dimethyl-4-(3-nitrophenyl)-1-oxidanyl-4H-pyridine-3,5-dicarboxylate Openeye Name: O5-(1-benzyl-4-piperidyl) O3-methyl 1-hydroxy-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-hydroxy-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid O3-methyl ester O5-[1-(phenylmethyl)-4-piperidinyl] ester IUPAC Name: 5-O-(1-benzylpiperidin-4-yl) 3-O-methyl 1-hydroxy-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-hydroxy-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid O5-(1-benzyl-4-piperidyl) ester O3-methyl ester Formula: C28H31N3O7 MolecularWeight: 521.56164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1O)C)C(=O)OC2CCN(CC2)CC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1O)C)C(=O)OC2CCN(CC2)CC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C28H31N3O7/c1-18-24(27(32)37-3)26(21-10-7-11-22(16-21)31(35)36)25(19(2)30(18)34)28(33)38-23-12-14-29(15-13-23)17-20-8-5-4-6-9-20/h4-11,16,23,26,34H,12-15,17H2,1-3H3