4-[bis[2,5,7-tris(oxidanyl)-4-oxidanylidene-chromen-3-yl]methyl]benzoic acid

Systemtic Name: 4-[bis[2,5,7-tris(oxidanyl)-4-oxidanylidene-chromen-3-yl]methyl]benzoic acid Openeye Name: 4-[bis(2,5,7-trihydroxy-4-oxo-chromen-3-yl)methyl]benzoic acid CAS Name: 4-[bis(2,5,7-trihydroxy-4-oxo-1-benzopyran-3-yl)methyl]benzoic acid IUPAC Name: 4-[bis(2,5,7-trihydroxy-4-oxochromen-3-yl)methyl]benzoic acid Traditional Name: 4-[bis(2,5,7-trihydroxy-4-keto-chromen-3-yl)methyl]benzoic acid Formula: C26H16O12 MolecularWeight: 520.39804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C2=C(OC3=CC(=CC(=C3C2=O)O)O)O)C4=C(OC5=CC(=CC(=C5C4=O)O)O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(C2=C(OC3=CC(=CC(=C3C2=O)O)O)O)C4=C(OC5=CC(=CC(=C5C4=O)O)O)O)C(=O)O

InChI

InChI=1S/C26H16O12/c27-11-5-13(29)18-15(7-11)37-25(35)20(22(18)31)17(9-1-3-10(4-2-9)24(33)34)21-23(32)19-14(30)6-12(28)8-16(19)38-26(21)36/h1-8,17,27-30,35-36H,(H,33,34)