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

Systemtic Name: ethyl 1-[2-(4-chlorophenyl)ethanethioyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(4-chlorophenyl)ethanethioyl]piperidine-4-carboxylate CAS Name: 1-[2-(4-chlorophenyl)-1-sulfanylideneethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-chlorophenyl)ethanethioyl]piperidine-4-carboxylate Traditional Name: 1-[2-(4-chlorophenyl)thioacetyl]isonipecotic acid ethyl ester Formula: C16H20ClNO2S MolecularWeight: 325.8535

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=S)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=S)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H20ClNO2S/c1-2-20-16(19)13-7-9-18(10-8-13)15(21)11-12-3-5-14(17)6-4-12/h3-6,13H,2,7-11H2,1H3