(2S)-2-(4-methylphenyl)-2-(propylamino)propanenitrile

Systemtic Name: (2S)-2-(4-methylphenyl)-2-(propylamino)propanenitrile Openeye Name: (2S)-2-(propylamino)-2-(p-tolyl)propanenitrile CAS Name: (2S)-2-(4-methylphenyl)-2-(propylamino)propanenitrile IUPAC Name: (2S)-2-(4-methylphenyl)-2-(propylamino)propanenitrile Traditional Name: (2S)-2-(propylamino)-2-(p-tolyl)propionitrile Formula: C13H18N2 MolecularWeight: 202.29542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2/c1-4-9-15-13(3,10-14)12-7-5-11(2)6-8-12/h5-8,15H,4,9H2,1-3H3/t13-/m1/s1