1-[3-(2-chlorophenyl)propanoyl]-4-(phenylmethyl)piperidine-4-carboxylic acid

Systemtic Name: 1-[3-(2-chlorophenyl)propanoyl]-4-(phenylmethyl)piperidine-4-carboxylic acid Openeye Name: 4-benzyl-1-[3-(2-chlorophenyl)propanoyl]piperidine-4-carboxylic acid CAS Name: 1-[3-(2-chlorophenyl)-1-oxopropyl]-4-(phenylmethyl)-4-piperidinecarboxylic acid IUPAC Name: 4-benzyl-1-[3-(2-chlorophenyl)propanoyl]piperidine-4-carboxylic acid Traditional Name: 4-benzyl-1-[3-(2-chlorophenyl)propanoyl]isonipecotic acid Formula: C22H24ClNO3 MolecularWeight: 385.88386

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CC2=CC=CC=C2)C(=O)O)C(=O)CCC3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CCC1(CC2=CC=CC=C2)C(=O)O)C(=O)CCC3=CC=CC=C3Cl

InChI

InChI=1S/C22H24ClNO3/c23-19-9-5-4-8-18(19)10-11-20(25)24-14-12-22(13-15-24,21(26)27)16-17-6-2-1-3-7-17/h1-9H,10-16H2,(H,26,27)