(2S)-2-(4-dimethylaminophenyl)-2-[(2-methyl-1-oxidanyl-propan-2-yl)amino]ethanenitrile

Systemtic Name: (2S)-2-(4-dimethylaminophenyl)-2-[(2-methyl-1-oxidanyl-propan-2-yl)amino]ethanenitrile Openeye Name: (2S)-2-(4-dimethylaminophenyl)-2-[(2-hydroxy-1,1-dimethyl-ethyl)amino]acetonitrile CAS Name: (2S)-2-(4-dimethylaminophenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)amino]acetonitrile IUPAC Name: (2S)-2-(4-dimethylaminophenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)amino]acetonitrile Traditional Name: (2S)-2-(4-dimethylaminophenyl)-2-[(2-hydroxy-1,1-dimethyl-ethyl)amino]acetonitrile Formula: C14H21N3O MolecularWeight: 247.33604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)NC(C#N)C1=CC=C(C=C1)N(C)C

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O/c1-14(2,10-18)16-13(9-15)11-5-7-12(8-6-11)17(3)4/h5-8,13,16,18H,10H2,1-4H3/t13-/m1/s1