5-methyl-2-propan-2-yl-benzenesulfonic acid

Systemtic Name: 5-methyl-2-propan-2-yl-benzenesulfonic acid Openeye Name: 2-isopropyl-5-methyl-benzenesulfonic acid CAS Name: 5-methyl-2-propan-2-ylbenzenesulfonic acid IUPAC Name: 5-methyl-2-propan-2-ylbenzenesulfonic acid Traditional Name: 2-isopropyl-5-methyl-besylic acid Formula: C10H14O3S MolecularWeight: 214.28136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O3S/c1-7(2)9-5-4-8(3)6-10(9)14(11,12)13/h4-7H,1-3H3,(H,11,12,13)