7-methoxy-5-(1-methoxybutyl)-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 7-methoxy-5-(1-methoxybutyl)-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 7-methoxy-5-(1-methoxybutyl)-9-oxo-xanthene-2-carboxylic acid CAS Name: 7-methoxy-5-(1-methoxybutyl)-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 7-methoxy-5-(1-methoxybutyl)-9-oxoxanthene-2-carboxylic acid Traditional Name: 9-keto-7-methoxy-5-(1-methoxybutyl)xanthene-2-carboxylic acid Formula: C20H20O6 MolecularWeight: 356.3692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20O6/c1-4-5-16(25-3)14-9-12(24-2)10-15-18(21)13-8-11(20(22)23)6-7-17(13)26-19(14)15/h6-10,16H,4-5H2,1-3H3,(H,22,23)