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

Systemtic Name: phenyl (4S)-4-(4-chlorophenyl)-1-methyl-piperidine-3-carboxylate Openeye Name: phenyl (4S)-4-(4-chlorophenyl)-1-methyl-piperidine-3-carboxylate CAS Name: (4S)-4-(4-chlorophenyl)-1-methyl-3-piperidinecarboxylic acid phenyl ester IUPAC Name: phenyl (4S)-4-(4-chlorophenyl)-1-methylpiperidine-3-carboxylate Traditional Name: (4S)-4-(4-chlorophenyl)-1-methyl-nipecotic acid phenyl ester Formula: C19H20ClNO2 MolecularWeight: 329.8206

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1)C(=O)OC2=CC=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN1CC[C@@H](C(C1)C(=O)OC2=CC=CC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H20ClNO2/c1-21-12-11-17(14-7-9-15(20)10-8-14)18(13-21)19(22)23-16-5-3-2-4-6-16/h2-10,17-18H,11-13H2,1H3/t17-,18?/m1/s1