2-[4-(diphenylmethyl)sulfanylpiperidin-1-yl]butanoate

Systemtic Name: 2-[4-(diphenylmethyl)sulfanylpiperidin-1-yl]butanoate Openeye Name: 2-(4-benzhydrylsulfanyl-1-piperidyl)butanoate CAS Name: 2-[4-[(diphenylmethyl)thio]-1-piperidinyl]butanoate IUPAC Name: 2-(4-benzhydrylsulfanylpiperidin-1-yl)butanoate Traditional Name: 2-[4-(benzhydrylthio)piperidino]butyrate Formula: C22H26NO2S- MolecularWeight: 368.51234

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])N1CCC(CC1)SC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)[O-])N1CCC(CC1)SC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H27NO2S/c1-2-20(22(24)25)23-15-13-19(14-16-23)26-21(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,19-21H,2,13-16H2,1H3,(H,24,25)/p-1