ethyl 1-(3-phenylsulfanylpropyl)piperidine-4-carboxylate hydrochloride

Systemtic Name: ethyl 1-(3-phenylsulfanylpropyl)piperidine-4-carboxylate hydrochloride Openeye Name: ethyl 1-(3-phenylsulfanylpropyl)piperidine-4-carboxylate hydrochloride CAS Name: 1-[3-(phenylthio)propyl]-4-piperidinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 1-(3-phenylsulfanylpropyl)piperidine-4-carboxylate hydrochloride Traditional Name: 1-[3-(phenylthio)propyl]isonipecotic acid ethyl ester hydrochloride Formula: C17H26ClNO2S MolecularWeight: 343.91184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CCCSC2=CC=CC=C2.Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CCCSC2=CC=CC=C2.Cl

InChI

InChI=1S/C17H25NO2S.ClH/c1-2-20-17(19)15-9-12-18(13-10-15)11-6-14-21-16-7-4-3-5-8-16;/h3-5,7-8,15H,2,6,9-14H2,1H3;1H