2-methyl-2-(4-methylphenyl)pentanenitrile

Systemtic Name: 2-methyl-2-(4-methylphenyl)pentanenitrile Openeye Name: 2-methyl-2-(p-tolyl)pentanenitrile CAS Name: 2-methyl-2-(4-methylphenyl)pentanenitrile IUPAC Name: 2-methyl-2-(4-methylphenyl)pentanenitrile Traditional Name: 2-methyl-2-(p-tolyl)valeronitrile Formula: C13H17N MolecularWeight: 187.28078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N/c1-4-9-13(3,10-14)12-7-5-11(2)6-8-12/h5-8H,4,9H2,1-3H3