4-ethanoyl-2-(3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzoate

Systemtic Name: 4-ethanoyl-2-(3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzoate Openeye Name: 4-acetyl-2-(3-hydroxy-6-oxo-xanthen-9-yl)benzoate CAS Name: 4-acetyl-2-(3-hydroxy-6-oxo-9-xanthenyl)benzoate IUPAC Name: 4-acetyl-2-(3-hydroxy-6-oxoxanthen-9-yl)benzoate Traditional Name: 4-acetyl-2-(3-hydroxy-6-keto-xanthen-9-yl)benzoate Formula: C22H13O6- MolecularWeight: 373.33502

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)C(=O)[O-])C2=C3C=CC(=O)C=C3OC4=C2C=CC(=C4)O

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)C(=O)[O-])C2=C3C=CC(=O)C=C3OC4=C2C=CC(=C4)O

InChI

InChI=1S/C22H14O6/c1-11(23)12-2-5-15(22(26)27)18(8-12)21-16-6-3-13(24)9-19(16)28-20-10-14(25)4-7-17(20)21/h2-10,24H,1H3,(H,26,27)/p-1