(2S)-2-(4-methylphenyl)butanenitrile

Systemtic Name: (2S)-2-(4-methylphenyl)butanenitrile Openeye Name: (2S)-2-(p-tolyl)butanenitrile CAS Name: (2S)-2-(4-methylphenyl)butanenitrile IUPAC Name: (2S)-2-(4-methylphenyl)butanenitrile Traditional Name: (2S)-2-(p-tolyl)butyronitrile Formula: C11H13N MolecularWeight: 159.22762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C#N)C1=CC=C(C=C1)C

InChI

InChI=1S/C11H13N/c1-3-10(8-12)11-6-4-9(2)5-7-11/h4-7,10H,3H2,1-2H3/t10-/m1/s1