5,7-bis(1-acetyloxyethyl)-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 5,7-bis(1-acetyloxyethyl)-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 5,7-bis(1-acetoxyethyl)-9-oxo-xanthene-2-carboxylic acid CAS Name: 5,7-bis(1-acetyloxyethyl)-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 5,7-bis(1-acetyloxyethyl)-9-oxoxanthene-2-carboxylic acid Traditional Name: 5,7-bis(1-acetoxyethyl)-9-keto-xanthene-2-carboxylic acid Formula: C22H20O8 MolecularWeight: 412.3894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20O8/c1-10(28-12(3)23)15-8-16(11(2)29-13(4)24)21-18(9-15)20(25)17-7-14(22(26)27)5-6-19(17)30-21/h5-11H,1-4H3,(H,26,27)