9-oxidanylidene-5-propanoyl-7-propoxy-xanthene-2-carboxylic acid

Systemtic Name: 9-oxidanylidene-5-propanoyl-7-propoxy-xanthene-2-carboxylic acid Openeye Name: 9-oxo-5-propanoyl-7-propoxy-xanthene-2-carboxylic acid CAS Name: 9-oxo-5-(1-oxopropyl)-7-propoxy-2-xanthenecarboxylic acid IUPAC Name: 9-oxo-5-propanoyl-7-propoxyxanthene-2-carboxylic acid Traditional Name: 9-keto-5-propionyl-7-propoxy-xanthene-2-carboxylic acid Formula: C20H18O6 MolecularWeight: 354.35332

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O)C(=O)CC

Isomeric SMILES

CCCOC1=CC(=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O)C(=O)CC

InChI

InChI=1S/C20H18O6/c1-3-7-25-12-9-13(16(21)4-2)19-15(10-12)18(22)14-8-11(20(23)24)5-6-17(14)26-19/h5-6,8-10H,3-4,7H2,1-2H3,(H,23,24)