methyl 1-[2-(4-chlorophenyl)sulfanylpropanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(4-chlorophenyl)sulfanylpropanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(4-chlorophenyl)sulfanylpropanoyl]piperidine-4-carboxylate CAS Name: 1-[2-[(4-chlorophenyl)thio]-1-oxopropyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(4-chlorophenyl)sulfanylpropanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(4-chlorophenyl)thio]propanoyl]isonipecotic acid methyl ester Formula: C16H20ClNO3S MolecularWeight: 341.8529

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)C(=O)OC)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)N1CCC(CC1)C(=O)OC)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H20ClNO3S/c1-11(22-14-5-3-13(17)4-6-14)15(19)18-9-7-12(8-10-18)16(20)21-2/h3-6,11-12H,7-10H2,1-2H3