3-(6-oxidanyl-3-oxidanylidene-xanthen-1-yl)phthalic acid

Systemtic Name: 3-(6-oxidanyl-3-oxidanylidene-xanthen-1-yl)phthalic acid Openeye Name: 3-(6-hydroxy-3-oxo-xanthen-1-yl)phthalic acid CAS Name: 3-(6-hydroxy-3-oxo-1-xanthenyl)phthalic acid IUPAC Name: 3-(6-hydroxy-3-oxoxanthen-1-yl)phthalic acid Traditional Name: 3-(6-hydroxy-3-keto-xanthen-1-yl)phthalic acid Formula: C21H12O7 MolecularWeight: 376.31578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)C(=O)O)C(=O)O)C2=CC(=O)C=C3C2=CC4=C(O3)C=C(C=C4)O

Isomeric SMILES

C1=CC(=C(C(=C1)C(=O)O)C(=O)O)C2=CC(=O)C=C3C2=CC4=C(O3)C=C(C=C4)O

InChI

InChI=1S/C21H12O7/c22-11-5-4-10-6-16-15(7-12(23)9-18(16)28-17(10)8-11)13-2-1-3-14(20(24)25)19(13)21(26)27/h1-9,22H,(H,24,25)(H,26,27)