5-methanoyloxy-6-oxidanylidene-2-(2-sulfophenyl)cyclohexa-1,3-diene-1-sulfonic acid

Systemtic Name: 5-methanoyloxy-6-oxidanylidene-2-(2-sulfophenyl)cyclohexa-1,3-diene-1-sulfonic acid Openeye Name: 5-formyloxy-6-oxo-2-(2-sulfophenyl)cyclohexa-1,3-diene-1-sulfonic acid CAS Name: 5-formyloxy-6-oxo-2-(2-sulfophenyl)-1-cyclohexa-1,3-dienesulfonic acid IUPAC Name: 5-formyloxy-6-oxo-2-(2-sulfophenyl)cyclohexa-1,3-diene-1-sulfonic acid Traditional Name: 5-formyloxy-6-keto-2-(2-sulfophenyl)cyclohexa-1,3-diene-1-sulfonic acid Formula: C13H10O9S2 MolecularWeight: 374.3431

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(C(=O)C(C=C2)OC=O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(C(=O)C(C=C2)OC=O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C13H10O9S2/c14-7-22-10-6-5-9(13(12(10)15)24(19,20)21)8-3-1-2-4-11(8)23(16,17)18/h1-7,10H,(H,16,17,18)(H,19,20,21)