methyl 1-(2-phenylsulfanylethanoyl)piperidine-4-carboxylate

Systemtic Name: methyl 1-(2-phenylsulfanylethanoyl)piperidine-4-carboxylate Openeye Name: methyl 1-(2-phenylsulfanylacetyl)piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-(phenylthio)ethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-phenylsulfanylacetyl)piperidine-4-carboxylate Traditional Name: 1-[2-(phenylthio)acetyl]isonipecotic acid methyl ester Formula: C15H19NO3S MolecularWeight: 293.38126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CSC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CSC2=CC=CC=C2

InChI

InChI=1S/C15H19NO3S/c1-19-15(18)12-7-9-16(10-8-12)14(17)11-20-13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3