1,3-bis(1-hydroxyethyl)-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 1,3-bis(1-hydroxyethyl)-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 1,3-bis(1-hydroxyethyl)-9-oxo-xanthene-2-carboxylic acid CAS Name: 1,3-bis(1-hydroxyethyl)-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 1,3-bis(1-hydroxyethyl)-9-oxoxanthene-2-carboxylic acid Traditional Name: 1,3-bis(1-hydroxyethyl)-9-keto-xanthene-2-carboxylic acid Formula: C18H16O6 MolecularWeight: 328.31604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C(=C1C(=O)O)C(C)O)C(=O)C3=CC=CC=C3O2)O

Isomeric SMILES

CC(C1=CC2=C(C(=C1C(=O)O)C(C)O)C(=O)C3=CC=CC=C3O2)O

InChI

InChI=1S/C18H16O6/c1-8(19)11-7-13-16(14(9(2)20)15(11)18(22)23)17(21)10-5-3-4-6-12(10)24-13/h3-9,19-20H,1-2H3,(H,22,23)