ethyl 1-(2-methylsulfanylethyl)-4-phenyl-piperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-methylsulfanylethyl)-4-phenyl-piperidine-4-carboxylate Openeye Name: ethyl 1-(2-methylsulfanylethyl)-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[2-(methylthio)ethyl]-4-phenyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-methylsulfanylethyl)-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[2-(methylthio)ethyl]-4-phenyl-isonipecotic acid ethyl ester Formula: C17H25NO2S MolecularWeight: 307.4509

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CCSC)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CCSC)C2=CC=CC=C2

InChI

InChI=1S/C17H25NO2S/c1-3-20-16(19)17(15-7-5-4-6-8-15)9-11-18(12-10-17)13-14-21-2/h4-8H,3,9-14H2,1-2H3