5-methanoyl-2-methyl-benzenesulfonic acid

Systemtic Name: 5-methanoyl-2-methyl-benzenesulfonic acid Openeye Name: 5-formyl-2-methyl-benzenesulfonic acid CAS Name: 5-formyl-2-methylbenzenesulfonic acid IUPAC Name: 5-formyl-2-methylbenzenesulfonic acid Traditional Name: 5-formyl-2-methyl-besylic acid Formula: C8H8O4S MolecularWeight: 200.21172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8O4S/c1-6-2-3-7(5-9)4-8(6)13(10,11)12/h2-5H,1H3,(H,10,11,12)