4-[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-1-carboxylic acid

Systemtic Name: 4-[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-1-carboxylic acid Openeye Name: 4-[2-[(2-chlorophenyl)methylamino]-2-oxo-ethyl]-4-phenyl-piperidine-1-carboxylic acid CAS Name: 4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-4-phenyl-1-piperidinecarboxylic acid IUPAC Name: 4-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]-4-phenylpiperidine-1-carboxylic acid Traditional Name: 4-[2-[(2-chlorobenzyl)amino]-2-keto-ethyl]-4-phenyl-piperidine-1-carboxylic acid Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CC(=O)NCC2=CC=CC=C2Cl)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CN(CCC1(CC(=O)NCC2=CC=CC=C2Cl)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H23ClN2O3/c22-18-9-5-4-6-16(18)15-23-19(25)14-21(17-7-2-1-3-8-17)10-12-24(13-11-21)20(26)27/h1-9H,10-15H2,(H,23,25)(H,26,27)