(2S)-2-(3-bromophenyl)-2-(3-methylbutylamino)ethanenitrile

Systemtic Name: (2S)-2-(3-bromophenyl)-2-(3-methylbutylamino)ethanenitrile Openeye Name: (2S)-2-(3-bromophenyl)-2-(isopentylamino)acetonitrile CAS Name: (2S)-2-(3-bromophenyl)-2-(3-methylbutylamino)acetonitrile IUPAC Name: (2S)-2-(3-bromophenyl)-2-(3-methylbutylamino)acetonitrile Traditional Name: (2S)-2-(3-bromophenyl)-2-(isoamylamino)acetonitrile Formula: C13H17BrN2 MolecularWeight: 281.19148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(C#N)C1=CC(=CC=C1)Br

Isomeric SMILES

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

InChI

InChI=1S/C13H17BrN2/c1-10(2)6-7-16-13(9-15)11-4-3-5-12(14)8-11/h3-5,8,10,13,16H,6-7H2,1-2H3/t13-/m1/s1