9-oxidanylidene-5,7-bis(propan-2-ylsulfinyl)xanthene-2-carboxylic acid

Systemtic Name: 9-oxidanylidene-5,7-bis(propan-2-ylsulfinyl)xanthene-2-carboxylic acid Openeye Name: 5,7-bis(isopropylsulfinyl)-9-oxo-xanthene-2-carboxylic acid CAS Name: 9-oxo-5,7-bis(propan-2-ylsulfinyl)-2-xanthenecarboxylic acid IUPAC Name: 9-oxo-5,7-bis(propan-2-ylsulfinyl)xanthene-2-carboxylic acid Traditional Name: 5,7-bis(isopropylsulfinyl)-9-keto-xanthene-2-carboxylic acid Formula: C20H20O6S2 MolecularWeight: 420.4992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20O6S2/c1-10(2)27(24)13-8-15-18(21)14-7-12(20(22)23)5-6-16(14)26-19(15)17(9-13)28(25)11(3)4/h5-11H,1-4H3,(H,22,23)