methyl (4S)-4-(4-chlorophenyl)-1-(phenylmethyl)piperidine-3-carboxylate

Systemtic Name: methyl (4S)-4-(4-chlorophenyl)-1-(phenylmethyl)piperidine-3-carboxylate Openeye Name: methyl (4S)-1-benzyl-4-(4-chlorophenyl)piperidine-3-carboxylate CAS Name: (4S)-4-(4-chlorophenyl)-1-(phenylmethyl)-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (4S)-1-benzyl-4-(4-chlorophenyl)piperidine-3-carboxylate Traditional Name: (4S)-1-benzyl-4-(4-chlorophenyl)nipecotic acid methyl ester Formula: C20H22ClNO2 MolecularWeight: 343.84718

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCC1C2=CC=C(C=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1CN(CC[C@@H]1C2=CC=C(C=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C20H22ClNO2/c1-24-20(23)19-14-22(13-15-5-3-2-4-6-15)12-11-18(19)16-7-9-17(21)10-8-16/h2-10,18-19H,11-14H2,1H3/t18-,19?/m1/s1