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

Systemtic Name: 5,7-bis(methylsulfonyl)-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 5,7-bis(methylsulfonyl)-9-oxo-xanthene-2-carboxylic acid CAS Name: 5,7-bis(methylsulfonyl)-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 5,7-bis(methylsulfonyl)-9-oxoxanthene-2-carboxylic acid Traditional Name: 9-keto-5,7-dimesyl-xanthene-2-carboxylic acid Formula: C16H12O8S2 MolecularWeight: 396.39168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12O8S2/c1-25(20,21)9-6-11-14(17)10-5-8(16(18)19)3-4-12(10)24-15(11)13(7-9)26(2,22)23/h3-7H,1-2H3,(H,18,19)