ethyl 1-[2-(2-chlorophenyl)sulfanylethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(2-chlorophenyl)sulfanylethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(2-chlorophenyl)sulfanylacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(2-chlorophenyl)thio]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2-chlorophenyl)sulfanylacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(2-chlorophenyl)thio]acetyl]isonipecotic acid ethyl ester Formula: C16H20ClNO3S MolecularWeight: 341.8529

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CSC2=CC=CC=C2Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CSC2=CC=CC=C2Cl

InChI

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