[4-(2,2-dicyanoethenyl)phenyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [4-(2,2-dicyanoethenyl)phenyl] 3,4,5-trimethoxybenzoate Openeye Name: [4-(2,2-dicyanovinyl)phenyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [4-(2,2-dicyanoethenyl)phenyl] ester IUPAC Name: [4-(2,2-dicyanoethenyl)phenyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [4-(2,2-dicyanovinyl)phenyl] ester Formula: C20H16N2O5 MolecularWeight: 364.35144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC=C(C=C2)C=C(C#N)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC=C(C=C2)C=C(C#N)C#N

InChI

InChI=1S/C20H16N2O5/c1-24-17-9-15(10-18(25-2)19(17)26-3)20(23)27-16-6-4-13(5-7-16)8-14(11-21)12-22/h4-10H,1-3H3