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

Systemtic Name: [4-(2,2-dicyanoethenyl)-2-methoxy-phenyl] 3,4,5-trimethoxybenzoate Openeye Name: [4-(2,2-dicyanovinyl)-2-methoxy-phenyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [4-(2,2-dicyanoethenyl)-2-methoxyphenyl] ester IUPAC Name: [4-(2,2-dicyanoethenyl)-2-methoxyphenyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [4-(2,2-dicyanovinyl)-2-methoxy-phenyl] ester Formula: C21H18N2O6 MolecularWeight: 394.37742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N2O6/c1-25-17-8-13(7-14(11-22)12-23)5-6-16(17)29-21(24)15-9-18(26-2)20(28-4)19(10-15)27-3/h5-10H,1-4H3