4-ethenyl-4-methyl-cyclohexa-2,5-diene-1-sulfonic acid

Systemtic Name: 4-ethenyl-4-methyl-cyclohexa-2,5-diene-1-sulfonic acid Openeye Name: 4-methyl-4-vinyl-cyclohexa-2,5-diene-1-sulfonic acid CAS Name: 4-ethenyl-4-methyl-1-cyclohexa-2,5-dienesulfonic acid IUPAC Name: 4-ethenyl-4-methylcyclohexa-2,5-diene-1-sulfonic acid Traditional Name: 4-methyl-4-vinyl-cyclohexa-2,5-diene-1-sulfonic acid Formula: C9H12O3S MolecularWeight: 200.25478

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(C=C1)S(=O)(=O)O)C=C

Isomeric SMILES

CC1(C=CC(C=C1)S(=O)(=O)O)C=C

InChI

InChI=1S/C9H12O3S/c1-3-9(2)6-4-8(5-7-9)13(10,11)12/h3-8H,1H2,2H3,(H,10,11,12)