2,5-bis(3,4-dimethoxyphenyl)-3,4-bis(oxidanylidene)hexanedinitrile

Systemtic Name: 2,5-bis(3,4-dimethoxyphenyl)-3,4-bis(oxidanylidene)hexanedinitrile Openeye Name: 2,5-bis(3,4-dimethoxyphenyl)-3,4-dioxo-hexanedinitrile CAS Name: 2,5-bis(3,4-dimethoxyphenyl)-3,4-dioxohexanedinitrile IUPAC Name: 2,5-bis(3,4-dimethoxyphenyl)-3,4-dioxohexanedinitrile Traditional Name: 2,5-bis(3,4-dimethoxyphenyl)-3,4-diketo-adiponitrile Formula: C22H20N2O6 MolecularWeight: 408.404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C#N)C(=O)C(=O)C(C#N)C2=CC(=C(C=C2)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C#N)C(=O)C(=O)C(C#N)C2=CC(=C(C=C2)OC)OC)OC

InChI

InChI=1S/C22H20N2O6/c1-27-17-7-5-13(9-19(17)29-3)15(11-23)21(25)22(26)16(12-24)14-6-8-18(28-2)20(10-14)30-4/h5-10,15-16H,1-4H3