4-methylbenzenesulfonic acid

Systemtic Name: 4-methylbenzenesulfonic acid Openeye Name: 4-methylbenzenesulfonic acid CAS Name: 4-methylbenzenesulfonic acid IUPAC Name: 4-methylbenzenesulfonic acid Traditional Name: tosylic acid Formula: C14H16O6S2 MolecularWeight: 344.40324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C7H8O3S/c2*1-6-2-4-7(5-3-6)11(8,9)10/h2*2-5H,1H3,(H,8,9,10)