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

Systemtic Name: [2-(3,4-dimethoxyphenyl)-4-oxidanylidene-chromen-3-yl] 3-phenylpropanoate Openeye Name: [2-(3,4-dimethoxyphenyl)-4-oxo-chromen-3-yl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [2-(3,4-dimethoxyphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-4-oxochromen-3-yl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [2-(3,4-dimethoxyphenyl)-4-keto-chromen-3-yl] ester Formula: C26H22O6 MolecularWeight: 430.44928

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)CCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)CCC4=CC=CC=C4)OC

InChI

InChI=1S/C26H22O6/c1-29-21-14-13-18(16-22(21)30-2)25-26(24(28)19-10-6-7-11-20(19)31-25)32-23(27)15-12-17-8-4-3-5-9-17/h3-11,13-14,16H,12,15H2,1-2H3