2-(3-methylphenyl)-2-propan-2-yl-pentanenitrile hydrochloride

Systemtic Name: 2-(3-methylphenyl)-2-propan-2-yl-pentanenitrile hydrochloride Openeye Name: 2-isopropyl-2-(m-tolyl)pentanenitrile hydrochloride CAS Name: 2-(3-methylphenyl)-2-propan-2-ylpentanenitrile hydrochloride IUPAC Name: 2-(3-methylphenyl)-2-propan-2-ylpentanenitrile hydrochloride Traditional Name: 2-isopropyl-2-(m-tolyl)valeronitrile hydrochloride Formula: C15H22ClN MolecularWeight: 251.79488

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C#N)(C1=CC=CC(=C1)C)C(C)C.Cl

Isomeric SMILES

CCCC(C#N)(C1=CC=CC(=C1)C)C(C)C.Cl

InChI

InChI=1S/C15H21N.ClH/c1-5-9-15(11-16,12(2)3)14-8-6-7-13(4)10-14;/h6-8,10,12H,5,9H2,1-4H3;1H