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

Systemtic Name: 9-oxidanylidene-6-pentyl-xanthene-2-carboxylic acid Openeye Name: 9-oxo-6-pentyl-xanthene-2-carboxylic acid CAS Name: 9-oxo-6-pentyl-2-xanthenecarboxylic acid IUPAC Name: 9-oxo-6-pentylxanthene-2-carboxylic acid Traditional Name: 6-amyl-9-keto-xanthene-2-carboxylic acid Formula: C19H18O4 MolecularWeight: 310.34382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

Isomeric SMILES

CCCCCC1=CC2=C(C=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

InChI

InChI=1S/C19H18O4/c1-2-3-4-5-12-6-8-14-17(10-12)23-16-9-7-13(19(21)22)11-15(16)18(14)20/h6-11H,2-5H2,1H3,(H,21,22)