2-(3,4-dimethoxyphenyl)-3,4-bis(oxidanylidene)pentanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-3,4-bis(oxidanylidene)pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-3,4-dioxo-pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-3,4-dioxopentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-3,4-dioxopentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-3,4-diketo-valeronitrile Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO4/c1-8(15)13(16)10(7-14)9-4-5-11(17-2)12(6-9)18-3/h4-6,10H,1-3H3