5-[[2-(3,4-dimethoxyphenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl]oxymethyl]furan-2-carboxylic acid

Systemtic Name: 5-[[2-(3,4-dimethoxyphenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl]oxymethyl]furan-2-carboxylic acid Openeye Name: 5-[[2-(3,4-dimethoxyphenyl)-6,7-dimethyl-4-oxo-chromen-3-yl]oxymethyl]furan-2-carboxylic acid CAS Name: 5-[[2-(3,4-dimethoxyphenyl)-6,7-dimethyl-4-oxo-1-benzopyran-3-yl]oxymethyl]-2-furancarboxylic acid IUPAC Name: 5-[[2-(3,4-dimethoxyphenyl)-6,7-dimethyl-4-oxochromen-3-yl]oxymethyl]furan-2-carboxylic acid Traditional Name: 5-[[2-(3,4-dimethoxyphenyl)-4-keto-6,7-dimethyl-chromen-3-yl]oxymethyl]-2-furoic acid Formula: C25H22O8 MolecularWeight: 450.43738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC(=C(C=C3)OC)OC)OCC4=CC=C(O4)C(=O)O)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC(=C(C=C3)OC)OC)OCC4=CC=C(O4)C(=O)O)C

InChI

InChI=1S/C25H22O8/c1-13-9-17-20(10-14(13)2)33-23(15-5-7-18(29-3)21(11-15)30-4)24(22(17)26)31-12-16-6-8-19(32-16)25(27)28/h5-11H,12H2,1-4H3,(H,27,28)