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

Systemtic Name: 5-(3,4-dimethoxyphenyl)-4-oxidanylidene-pentanenitrile Openeye Name: 5-(3,4-dimethoxyphenyl)-4-oxo-pentanenitrile CAS Name: 5-(3,4-dimethoxyphenyl)-4-oxopentanenitrile IUPAC Name: 5-(3,4-dimethoxyphenyl)-4-oxopentanenitrile Traditional Name: 5-(3,4-dimethoxyphenyl)-4-keto-valeronitrile Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO3/c1-16-12-6-5-10(9-13(12)17-2)8-11(15)4-3-7-14/h5-6,9H,3-4,8H2,1-2H3