2-[(5-heptyl-7-oxidanyl-4-oxidanylidene-chromen-2-yl)methyl]-4,6-bis(oxidanyl)benzoic acid

Systemtic Name: 2-[(5-heptyl-7-oxidanyl-4-oxidanylidene-chromen-2-yl)methyl]-4,6-bis(oxidanyl)benzoic acid Openeye Name: 2-[(5-heptyl-7-hydroxy-4-oxo-chromen-2-yl)methyl]-4,6-dihydroxy-benzoic acid CAS Name: 2-[(5-heptyl-7-hydroxy-4-oxo-1-benzopyran-2-yl)methyl]-4,6-dihydroxybenzoic acid IUPAC Name: 2-[(5-heptyl-7-hydroxy-4-oxochromen-2-yl)methyl]-4,6-dihydroxybenzoic acid Traditional Name: 2-[(5-heptyl-7-hydroxy-4-keto-chromen-2-yl)methyl]-4,6-dihydroxy-benzoic acid Formula: C24H26O7 MolecularWeight: 426.45904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=CC2=C1C(=O)C=C(O2)CC3=CC(=CC(=C3C(=O)O)O)O)O

Isomeric SMILES

CCCCCCCC1=CC(=CC2=C1C(=O)C=C(O2)CC3=CC(=CC(=C3C(=O)O)O)O)O

InChI

InChI=1S/C24H26O7/c1-2-3-4-5-6-7-14-8-17(26)12-21-22(14)20(28)13-18(31-21)10-15-9-16(25)11-19(27)23(15)24(29)30/h8-9,11-13,25-27H,2-7,10H2,1H3,(H,29,30)