ethyl 1-(2-methoxy-4-methylsulfanyl-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-methoxy-4-methylsulfanyl-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(2-methoxy-4-methylsulfanyl-benzoyl)piperidine-4-carboxylate CAS Name: 1-[[2-methoxy-4-(methylthio)phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-methoxy-4-methylsulfanylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-[2-methoxy-4-(methylthio)benzoyl]isonipecotic acid ethyl ester Formula: C17H23NO4S MolecularWeight: 337.43382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=C(C=C2)SC)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=C(C=C2)SC)OC

InChI

InChI=1S/C17H23NO4S/c1-4-22-17(20)12-7-9-18(10-8-12)16(19)14-6-5-13(23-3)11-15(14)21-2/h5-6,11-12H,4,7-10H2,1-3H3