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

Systemtic Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(2-methylpropylamino)ethanenitrile Openeye Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(isobutylamino)acetonitrile CAS Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(2-methylpropylamino)acetonitrile IUPAC Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(2-methylpropylamino)acetonitrile Traditional Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(isobutylamino)acetonitrile Formula: C14H20N2O2 MolecularWeight: 248.3208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O2/c1-10(2)9-16-12(8-15)11-5-6-13(17-3)14(7-11)18-4/h5-7,10,12,16H,9H2,1-4H3/t12-/m1/s1