methyl 1-methyl-3-phenylsulfanyl-piperidine-4-carboxylate

Systemtic Name: methyl 1-methyl-3-phenylsulfanyl-piperidine-4-carboxylate Openeye Name: methyl 1-methyl-3-phenylsulfanyl-piperidine-4-carboxylate CAS Name: 1-methyl-3-(phenylthio)-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-methyl-3-phenylsulfanylpiperidine-4-carboxylate Traditional Name: 1-methyl-3-(phenylthio)isonipecotic acid methyl ester Formula: C14H19NO2S MolecularWeight: 265.37116

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1)SC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CN1CCC(C(C1)SC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C14H19NO2S/c1-15-9-8-12(14(16)17-2)13(10-15)18-11-6-4-3-5-7-11/h3-7,12-13H,8-10H2,1-2H3