Difenoxin Hydrochloride (1.0mg/ml in Methanol)

Analyte Name

Difenoxin (hydrochloride)

CAS Number

35607-36-4

Molecular Formula

C28 H28 N2 O2 . H Cl

Molecular Weight

461

Accurate Mass

460.192

SMILES

Cl.OC(=O)C1(CCN(CCC(C#N)(c2ccccc2)c3ccccc3)CC1)c4ccccc4

InChI

InChI=1S/C28H28N2O2.ClH/c29-22-28(24-12-6-2-7-13-24,25-14-8-3-9-15-25)18-21-30-19-16-27(17-20-30,26(31)32)23-10-4-1-5-11-23;/h1-15H,16-21H2,(H,31,32);1H

IUPAC

1-(3-cyano-3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylic acid;hydrochloride

Country of Origin

CANADA

Product Format

Single Solution

Matrix

Methanol