(4-nitrophenyl) 4-[bis(3-methoxyphenyl)-oxidanyl-methyl]piperidine-1-carboxylate

Systemtic Name: (4-nitrophenyl) 4-[bis(3-methoxyphenyl)-oxidanyl-methyl]piperidine-1-carboxylate Openeye Name: (4-nitrophenyl) 4-[hydroxy-bis(3-methoxyphenyl)methyl]piperidine-1-carboxylate CAS Name: 4-[hydroxy-bis(3-methoxyphenyl)methyl]-1-piperidinecarboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 4-[hydroxy-bis(3-methoxyphenyl)methyl]piperidine-1-carboxylate Traditional Name: 4-[hydroxy-bis(3-methoxyphenyl)methyl]piperidine-1-carboxylic acid (4-nitrophenyl) ester Formula: C27H28N2O7 MolecularWeight: 492.52042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C2CCN(CC2)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-])(C4=CC(=CC=C4)OC)O

Isomeric SMILES

COC1=CC=CC(=C1)C(C2CCN(CC2)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-])(C4=CC(=CC=C4)OC)O

InChI

InChI=1S/C27H28N2O7/c1-34-24-7-3-5-20(17-24)27(31,21-6-4-8-25(18-21)35-2)19-13-15-28(16-14-19)26(30)36-23-11-9-22(10-12-23)29(32)33/h3-12,17-19,31H,13-16H2,1-2H3