4-(3,5-dimethoxyphenyl)-4-oxidanylidene-butanenitrile

Systemtic Name: 4-(3,5-dimethoxyphenyl)-4-oxidanylidene-butanenitrile Openeye Name: 4-(3,5-dimethoxyphenyl)-4-oxo-butanenitrile CAS Name: 4-(3,5-dimethoxyphenyl)-4-oxobutanenitrile IUPAC Name: 4-(3,5-dimethoxyphenyl)-4-oxobutanenitrile Traditional Name: 4-(3,5-dimethoxyphenyl)-4-keto-butyronitrile Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)CCC#N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)CCC#N)OC

InChI

InChI=1S/C12H13NO3/c1-15-10-6-9(7-11(8-10)16-2)12(14)4-3-5-13/h6-8H,3-4H2,1-2H3