5-(1,3-dioxol-4-ylmethylsulfanyl)-6-oxidanylidene-cyclohexa-1,3-diene-1-sulfonic acid

Systemtic Name: 5-(1,3-dioxol-4-ylmethylsulfanyl)-6-oxidanylidene-cyclohexa-1,3-diene-1-sulfonic acid Openeye Name: 5-(1,3-dioxol-4-ylmethylsulfanyl)-6-oxo-cyclohexa-1,3-diene-1-sulfonic acid CAS Name: 5-(1,3-dioxol-4-ylmethylthio)-6-oxo-1-cyclohexa-1,3-dienesulfonic acid IUPAC Name: 5-(1,3-dioxol-4-ylmethylsulfanyl)-6-oxocyclohexa-1,3-diene-1-sulfonic acid Traditional Name: 5-(1,3-dioxol-4-ylmethylthio)-6-keto-cyclohexa-1,3-diene-1-sulfonic acid Formula: C10H10O6S2 MolecularWeight: 290.3128

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Descriptors Computed from Structure

Canonical SMILES:

C1OC=C(O1)CSC2C=CC=C(C2=O)S(=O)(=O)O

Isomeric SMILES

C1OC=C(O1)CSC2C=CC=C(C2=O)S(=O)(=O)O

InChI

InChI=1S/C10H10O6S2/c11-10-8(17-5-7-4-15-6-16-7)2-1-3-9(10)18(12,13)14/h1-4,8H,5-6H2,(H,12,13,14)