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

Systemtic Name: methyl (4S)-4-(4-chlorophenyl)-1-(phenylsulfonyl)piperidine-3-carboxylate Openeye Name: methyl (4S)-1-(benzenesulfonyl)-4-(4-chlorophenyl)piperidine-3-carboxylate CAS Name: (4S)-1-(benzenesulfonyl)-4-(4-chlorophenyl)-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (4S)-1-(benzenesulfonyl)-4-(4-chlorophenyl)piperidine-3-carboxylate Traditional Name: (4S)-1-besyl-4-(4-chlorophenyl)nipecotic acid methyl ester Formula: C19H20ClNO4S MolecularWeight: 393.8844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClNO4S/c1-25-19(22)18-13-21(26(23,24)16-5-3-2-4-6-16)12-11-17(18)14-7-9-15(20)10-8-14/h2-10,17-18H,11-13H2,1H3/t17-,18?/m1/s1