2-(2-dimethylaminoethyl)-2-(3-methylphenyl)-4-phenyl-butanenitrile hydrochloride

Systemtic Name: 2-(2-dimethylaminoethyl)-2-(3-methylphenyl)-4-phenyl-butanenitrile hydrochloride Openeye Name: 2-(2-dimethylaminoethyl)-2-(m-tolyl)-4-phenyl-butanenitrile hydrochloride CAS Name: 2-(2-dimethylaminoethyl)-2-(3-methylphenyl)-4-phenylbutanenitrile hydrochloride IUPAC Name: 2-(2-dimethylaminoethyl)-2-(3-methylphenyl)-4-phenylbutanenitrile hydrochloride Traditional Name: 2-(2-dimethylaminoethyl)-2-(m-tolyl)-4-phenyl-butyronitrile hydrochloride Formula: C21H27ClN2 MolecularWeight: 342.90548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CCC2=CC=CC=C2)(CCN(C)C)C#N.Cl

Isomeric SMILES

CC1=CC(=CC=C1)C(CCC2=CC=CC=C2)(CCN(C)C)C#N.Cl

InChI

InChI=1S/C21H26N2.ClH/c1-18-8-7-11-20(16-18)21(17-22,14-15-23(2)3)13-12-19-9-5-4-6-10-19;/h4-11,16H,12-15H2,1-3H3;1H