(2S)-2-(3,4-dimethoxyphenyl)-2-(3-methylbutylamino)ethanenitrile

Systemtic Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(3-methylbutylamino)ethanenitrile Openeye Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(isopentylamino)acetonitrile CAS Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(3-methylbutylamino)acetonitrile IUPAC Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(3-methylbutylamino)acetonitrile Traditional Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(isoamylamino)acetonitrile Formula: C15H22N2O2 MolecularWeight: 262.34738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O2/c1-11(2)7-8-17-13(10-16)12-5-6-14(18-3)15(9-12)19-4/h5-6,9,11,13,17H,7-8H2,1-4H3/t13-/m1/s1