7-ethylsulfonyl-5-methoxy-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 7-ethylsulfonyl-5-methoxy-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 7-ethylsulfonyl-5-methoxy-9-oxo-xanthene-2-carboxylic acid CAS Name: 7-ethylsulfonyl-5-methoxy-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 7-ethylsulfonyl-5-methoxy-9-oxoxanthene-2-carboxylic acid Traditional Name: 7-esyl-9-keto-5-methoxy-xanthene-2-carboxylic acid Formula: C17H14O7S MolecularWeight: 362.35386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14O7S/c1-3-25(21,22)10-7-12-15(18)11-6-9(17(19)20)4-5-13(11)24-16(12)14(8-10)23-2/h4-8H,3H2,1-2H3,(H,19,20)