(2S)-2-(3-methylphenyl)-2-(2-methylpropylamino)ethanenitrile

Systemtic Name: (2S)-2-(3-methylphenyl)-2-(2-methylpropylamino)ethanenitrile Openeye Name: (2S)-2-(isobutylamino)-2-(m-tolyl)acetonitrile CAS Name: (2S)-2-(3-methylphenyl)-2-(2-methylpropylamino)acetonitrile IUPAC Name: (2S)-2-(3-methylphenyl)-2-(2-methylpropylamino)acetonitrile Traditional Name: (2S)-2-(isobutylamino)-2-(m-tolyl)acetonitrile Formula: C13H18N2 MolecularWeight: 202.29542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C#N)NCC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)[C@@H](C#N)NCC(C)C

InChI

InChI=1S/C13H18N2/c1-10(2)9-15-13(8-14)12-6-4-5-11(3)7-12/h4-7,10,13,15H,9H2,1-3H3/t13-/m1/s1