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

Systemtic Name: (2S)-2-(2-dimethylaminoethylamino)-2-(3-methylphenyl)ethanenitrile Openeye Name: (2S)-2-(2-dimethylaminoethylamino)-2-(m-tolyl)acetonitrile CAS Name: (2S)-2-(2-dimethylaminoethylamino)-2-(3-methylphenyl)acetonitrile IUPAC Name: (2S)-2-(2-dimethylaminoethylamino)-2-(3-methylphenyl)acetonitrile Traditional Name: (2S)-2-(2-dimethylaminoethylamino)-2-(m-tolyl)acetonitrile Formula: C13H19N3 MolecularWeight: 217.31006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3/c1-11-5-4-6-12(9-11)13(10-14)15-7-8-16(2)3/h4-6,9,13,15H,7-8H2,1-3H3/t13-/m1/s1