6-methyl-1-sulfanyl-cyclohexa-2,4-diene-1-sulfonic acid

Systemtic Name: 6-methyl-1-sulfanyl-cyclohexa-2,4-diene-1-sulfonic acid Openeye Name: 6-methyl-1-sulfanyl-cyclohexa-2,4-diene-1-sulfonic acid CAS Name: 1-mercapto-6-methyl-1-cyclohexa-2,4-dienesulfonic acid IUPAC Name: 6-methyl-1-sulfanylcyclohexa-2,4-diene-1-sulfonic acid Traditional Name: 1-mercapto-6-methyl-cyclohexa-2,4-diene-1-sulfonic acid Formula: C7H10O3S2 MolecularWeight: 206.2825

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC=CC1(S)S(=O)(=O)O

Isomeric SMILES

CC1C=CC=CC1(S)S(=O)(=O)O

InChI

InChI=1S/C7H10O3S2/c1-6-4-2-3-5-7(6,11)12(8,9)10/h2-6,11H,1H3,(H,8,9,10)