2-[2-(3,4-dimethoxyphenyl)-5,6-dimethoxy-4-oxidanylidene-chromen-7-yl]oxyethanoic acid

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)-5,6-dimethoxy-4-oxidanylidene-chromen-7-yl]oxyethanoic acid Openeye Name: 2-[2-(3,4-dimethoxyphenyl)-5,6-dimethoxy-4-oxo-chromen-7-yl]oxyacetic acid CAS Name: 2-[[2-(3,4-dimethoxyphenyl)-5,6-dimethoxy-4-oxo-1-benzopyran-7-yl]oxy]acetic acid IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)-5,6-dimethoxy-4-oxochromen-7-yl]oxyacetic acid Traditional Name: 2-[2-(3,4-dimethoxyphenyl)-4-keto-5,6-dimethoxy-chromen-7-yl]oxyacetic acid Formula: C21H20O9 MolecularWeight: 416.3781

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20O9/c1-25-13-6-5-11(7-15(13)26-2)14-8-12(22)19-16(30-14)9-17(29-10-18(23)24)20(27-3)21(19)28-4/h5-9H,10H2,1-4H3,(H,23,24)