[2-(3,4-dimethoxyphenyl)-4-oxidanylidene-chromen-3-yl] pyridine-3-carboxylate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-4-oxidanylidene-chromen-3-yl] pyridine-3-carboxylate Openeye Name: [2-(3,4-dimethoxyphenyl)-4-oxo-chromen-3-yl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-(3,4-dimethoxyphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-4-oxochromen-3-yl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-(3,4-dimethoxyphenyl)-4-keto-chromen-3-yl] ester Formula: C23H17NO6 MolecularWeight: 403.38418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)C4=CN=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)C4=CN=CC=C4)OC

InChI

InChI=1S/C23H17NO6/c1-27-18-10-9-14(12-19(18)28-2)21-22(30-23(26)15-6-5-11-24-13-15)20(25)16-7-3-4-8-17(16)29-21/h3-13H,1-2H3