1-(4-chlorophenyl)carbonyl-4-(phenylmethyl)piperidine-4-carboxylic acid

Systemtic Name: 1-(4-chlorophenyl)carbonyl-4-(phenylmethyl)piperidine-4-carboxylic acid Openeye Name: 4-benzyl-1-(4-chlorobenzoyl)piperidine-4-carboxylic acid CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-4-(phenylmethyl)-4-piperidinecarboxylic acid IUPAC Name: 4-benzyl-1-(4-chlorobenzoyl)piperidine-4-carboxylic acid Traditional Name: 4-benzyl-1-(4-chlorobenzoyl)isonipecotic acid Formula: C20H20ClNO3 MolecularWeight: 357.8307

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CC2=CC=CC=C2)C(=O)O)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCC1(CC2=CC=CC=C2)C(=O)O)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClNO3/c21-17-8-6-16(7-9-17)18(23)22-12-10-20(11-13-22,19(24)25)14-15-4-2-1-3-5-15/h1-9H,10-14H2,(H,24,25)