(3R)-1-[3-(diphenylmethyl)sulfanylpropyl]piperidine-3-carboxylic acid hydrochloride

Systemtic Name: (3R)-1-[3-(diphenylmethyl)sulfanylpropyl]piperidine-3-carboxylic acid hydrochloride Openeye Name: (3R)-1-(3-benzhydrylsulfanylpropyl)piperidine-3-carboxylic acid hydrochloride CAS Name: (3R)-1-[3-[(diphenylmethyl)thio]propyl]-3-piperidinecarboxylic acid hydrochloride IUPAC Name: (3R)-1-(3-benzhydrylsulfanylpropyl)piperidine-3-carboxylic acid hydrochloride Traditional Name: (3R)-1-[3-(benzhydrylthio)propyl]nipecotic acid hydrochloride Formula: C22H28ClNO2S MolecularWeight: 405.98122

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCCSC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O.Cl

Isomeric SMILES

C1C[C@H](CN(C1)CCCSC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O.Cl

InChI

InChI=1S/C22H27NO2S.ClH/c24-22(25)20-13-7-14-23(17-20)15-8-16-26-21(18-9-3-1-4-10-18)19-11-5-2-6-12-19;/h1-6,9-12,20-21H,7-8,13-17H2,(H,24,25);1H/t20-;/m1./s1