2-(4,5-dimethanoyl-3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzoic acid

Systemtic Name: 2-(4,5-dimethanoyl-3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzoic acid Openeye Name: 2-(4,5-diformyl-3-hydroxy-6-oxo-xanthen-9-yl)benzoic acid CAS Name: 2-(4,5-diformyl-3-hydroxy-6-oxo-9-xanthenyl)benzoic acid IUPAC Name: 2-(4,5-diformyl-3-hydroxy-6-oxoxanthen-9-yl)benzoic acid Traditional Name: 2-(4,5-diformyl-3-hydroxy-6-keto-xanthen-9-yl)benzoic acid Formula: C22H12O7 MolecularWeight: 388.32648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C3C=CC(=O)C(=C3OC4=C2C=CC(=C4C=O)O)C=O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=C3C=CC(=O)C(=C3OC4=C2C=CC(=C4C=O)O)C=O)C(=O)O

InChI

InChI=1S/C22H12O7/c23-9-15-17(25)7-5-13-19(11-3-1-2-4-12(11)22(27)28)14-6-8-18(26)16(10-24)21(14)29-20(13)15/h1-10,25H,(H,27,28)