2-[[2-[3,4-bis(oxidanyl)phenyl]-5,7-bis(oxidanyl)-3,4-dihydro-2H-chromen-3-yl]oxycarbonyl]benzoic acid

Systemtic Name: 2-[[2-[3,4-bis(oxidanyl)phenyl]-5,7-bis(oxidanyl)-3,4-dihydro-2H-chromen-3-yl]oxycarbonyl]benzoic acid Openeye Name: 2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chroman-3-yl]oxycarbonylbenzoic acid CAS Name: 2-[[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl]oxy-oxomethyl]benzoic acid IUPAC Name: 2-[[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxycarbonyl]benzoic acid Traditional Name: 2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chroman-3-yl]oxycarbonylbenzoic acid Formula: C23H18O9 MolecularWeight: 438.38362

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C23H18O9/c24-12-8-17(26)15-10-20(32-23(30)14-4-2-1-3-13(14)22(28)29)21(31-19(15)9-12)11-5-6-16(25)18(27)7-11/h1-9,20-21,24-27H,10H2,(H,28,29)