2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethanoic acid; 3-(2-oxidanylidenechromen-3-yl)carbonyloxynaphthalene-2-carboxylic acid

Systemtic Name: 2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethanoic acid; 3-(2-oxidanylidenechromen-3-yl)carbonyloxynaphthalene-2-carboxylic acid Openeye Name: 2-(3,4-dimethoxyphenyl)-2-oxo-acetic acid; 3-(2-oxochromene-3-carbonyl)oxynaphthalene-2-carboxylic acid CAS Name: 2-(3,4-dimethoxyphenyl)-2-oxoacetic acid; 3-[oxo-(2-oxo-1-benzopyran-3-yl)methoxy]-2-naphthalenecarboxylic acid IUPAC Name: 2-(3,4-dimethoxyphenyl)-2-oxoacetic acid; 3-(2-oxochromene-3-carbonyl)oxynaphthalene-2-carboxylic acid Traditional Name: 2-(3,4-dimethoxyphenyl)-2-keto-acetic acid; 3-(2-ketochromene-3-carbonyl)oxy-2-naphthoic acid Formula: C31H22O11 MolecularWeight: 570.49978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C(=O)O)OC.C1=CC=C2C=C(C(=CC2=C1)C(=O)O)OC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C(=O)O)OC.C1=CC=C2C=C(C(=CC2=C1)C(=O)O)OC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C21H12O6.C10H10O5/c22-19(23)15-9-12-5-1-2-6-13(12)11-18(15)27-21(25)16-10-14-7-3-4-8-17(14)26-20(16)24;1-14-7-4-3-6(5-8(7)15-2)9(11)10(12)13/h1-11H,(H,22,23);3-5H,1-2H3,(H,12,13)