methyl 1-methyl-2-phenyl-3-(3-phenylsulfanylpropyl)piperidine-3-carboxylate

Systemtic Name: methyl 1-methyl-2-phenyl-3-(3-phenylsulfanylpropyl)piperidine-3-carboxylate Openeye Name: methyl 1-methyl-2-phenyl-3-(3-phenylsulfanylpropyl)piperidine-3-carboxylate CAS Name: 1-methyl-2-phenyl-3-[3-(phenylthio)propyl]-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-methyl-2-phenyl-3-(3-phenylsulfanylpropyl)piperidine-3-carboxylate Traditional Name: 1-methyl-2-phenyl-3-[3-(phenylthio)propyl]nipecotic acid methyl ester Formula: C23H29NO2S MolecularWeight: 383.54686

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1C2=CC=CC=C2)(CCCSC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CN1CCCC(C1C2=CC=CC=C2)(CCCSC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C23H29NO2S/c1-24-17-9-15-23(22(25)26-2,21(24)19-11-5-3-6-12-19)16-10-18-27-20-13-7-4-8-14-20/h3-8,11-14,21H,9-10,15-18H2,1-2H3