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

Systemtic Name: 5-methoxy-9-oxidanylidene-7-propanoyl-xanthene-2-carboxylic acid Openeye Name: 5-methoxy-9-oxo-7-propanoyl-xanthene-2-carboxylic acid CAS Name: 5-methoxy-9-oxo-7-(1-oxopropyl)-2-xanthenecarboxylic acid IUPAC Name: 5-methoxy-9-oxo-7-propanoylxanthene-2-carboxylic acid Traditional Name: 9-keto-5-methoxy-7-propionyl-xanthene-2-carboxylic acid Formula: C18H14O6 MolecularWeight: 326.30016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O)OC

Isomeric SMILES

CCC(=O)C1=CC(=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O)OC

InChI

InChI=1S/C18H14O6/c1-3-13(19)10-7-12-16(20)11-6-9(18(21)22)4-5-14(11)24-17(12)15(8-10)23-2/h4-8H,3H2,1-2H3,(H,21,22)