6-hexanoyl-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 6-hexanoyl-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 6-hexanoyl-9-oxo-xanthene-2-carboxylic acid CAS Name: 9-oxo-6-(1-oxohexyl)-2-xanthenecarboxylic acid IUPAC Name: 6-hexanoyl-9-oxoxanthene-2-carboxylic acid Traditional Name: 6-caproyl-9-keto-xanthene-2-carboxylic acid Formula: C20H18O5 MolecularWeight: 338.35392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=CC2=C(C=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

Isomeric SMILES

CCCCCC(=O)C1=CC2=C(C=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

InChI

InChI=1S/C20H18O5/c1-2-3-4-5-16(21)12-6-8-14-18(11-12)25-17-9-7-13(20(23)24)10-15(17)19(14)22/h6-11H,2-5H2,1H3,(H,23,24)