(2S)-2-(3,4-dimethoxyphenyl)-3-methyl-butanenitrile

Systemtic Name: (2S)-2-(3,4-dimethoxyphenyl)-3-methyl-butanenitrile Openeye Name: (2S)-2-(3,4-dimethoxyphenyl)-3-methyl-butanenitrile CAS Name: (2S)-2-(3,4-dimethoxyphenyl)-3-methylbutanenitrile IUPAC Name: (2S)-2-(3,4-dimethoxyphenyl)-3-methylbutanenitrile Traditional Name: (2S)-2-(3,4-dimethoxyphenyl)-3-methyl-butyronitrile Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO2/c1-9(2)11(8-14)10-5-6-12(15-3)13(7-10)16-4/h5-7,9,11H,1-4H3/t11-/m0/s1