[6-oxidanylidene-5-(sulfomethyl)cyclohexa-1,4-dien-1-yl]methanesulfonic acid

Systemtic Name: [6-oxidanylidene-5-(sulfomethyl)cyclohexa-1,4-dien-1-yl]methanesulfonic acid Openeye Name: [6-oxo-5-(sulfomethyl)cyclohexa-1,4-dien-1-yl]methanesulfonic acid CAS Name: [6-oxo-5-(sulfomethyl)-1-cyclohexa-1,4-dienyl]methanesulfonic acid IUPAC Name: [6-oxo-5-(sulfomethyl)cyclohexa-1,4-dien-1-yl]methanesulfonic acid Traditional Name: [6-keto-5-(sulfomethyl)cyclohexa-1,4-dien-1-yl]methanesulfonic acid Formula: C8H10O7S2 MolecularWeight: 282.2908

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C(=O)C(=C1)CS(=O)(=O)O)CS(=O)(=O)O

Isomeric SMILES

C1C=C(C(=O)C(=C1)CS(=O)(=O)O)CS(=O)(=O)O

InChI

InChI=1S/C8H10O7S2/c9-8-6(4-16(10,11)12)2-1-3-7(8)5-17(13,14)15/h2-3H,1,4-5H2,(H,10,11,12)(H,13,14,15)