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

Systemtic Name: ethyl 1-[2-[(4-chlorophenyl)methylsulfanyl]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(4-chlorophenyl)methylsulfanyl]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(4-chlorophenyl)methylthio]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(4-chlorophenyl)methylsulfanyl]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(4-chlorobenzyl)thio]acetyl]isonipecotic acid ethyl ester Formula: C17H22ClNO3S MolecularWeight: 355.87948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CSCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CSCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H22ClNO3S/c1-2-22-17(21)14-7-9-19(10-8-14)16(20)12-23-11-13-3-5-15(18)6-4-13/h3-6,14H,2,7-12H2,1H3