(2S)-2-(3-methoxyphenyl)-3-oxidanylidene-butanenitrile

Systemtic Name: (2S)-2-(3-methoxyphenyl)-3-oxidanylidene-butanenitrile Openeye Name: (2S)-2-(3-methoxyphenyl)-3-oxo-butanenitrile CAS Name: (2S)-2-(3-methoxyphenyl)-3-oxobutanenitrile IUPAC Name: (2S)-2-(3-methoxyphenyl)-3-oxobutanenitrile Traditional Name: (2S)-3-keto-2-(3-methoxyphenyl)butyronitrile Formula: C11H11NO2 MolecularWeight: 189.21054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO2/c1-8(13)11(7-12)9-4-3-5-10(6-9)14-2/h3-6,11H,1-2H3/t11-/m0/s1