1-[2-[3-naphthalen-2-yl-5-oxidanylidene-1-(phenylmethyl)pyrrolidin-3-yl]ethyl]-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[3-naphthalen-2-yl-5-oxidanylidene-1-(phenylmethyl)pyrrolidin-3-yl]ethyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[2-[1-benzyl-3-(2-naphthyl)-5-oxo-pyrrolidin-3-yl]ethyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[2-[3-(2-naphthalenyl)-5-oxo-1-(phenylmethyl)-3-pyrrolidinyl]ethyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(1-benzyl-3-naphthalen-2-yl-5-oxopyrrolidin-3-yl)ethyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[2-[1-benzyl-5-keto-3-(2-naphthyl)pyrrolidin-3-yl]ethyl]-4-phenyl-isonipecotic acid Formula: C35H36N2O3 MolecularWeight: 532.67194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C(=O)O)CCC3(CC(=O)N(C3)CC4=CC=CC=C4)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C(=O)O)CCC3(CC(=O)N(C3)CC4=CC=CC=C4)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C35H36N2O3/c38-32-24-34(26-37(32)25-27-9-3-1-4-10-27,31-16-15-28-11-7-8-12-29(28)23-31)17-20-36-21-18-35(19-22-36,33(39)40)30-13-5-2-6-14-30/h1-16,23H,17-22,24-26H2,(H,39,40)