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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO3/c1-15-11-4-3-9(8-12(11)16-2)7-10(14)5-6-13/h3-4,8H,5,7H2,1-2H3