3-oxidanyl-2-propan-2-yl-benzenesulfonic acid

Systemtic Name: 3-oxidanyl-2-propan-2-yl-benzenesulfonic acid Openeye Name: 3-hydroxy-2-isopropyl-benzenesulfonic acid CAS Name: 3-hydroxy-2-propan-2-ylbenzenesulfonic acid IUPAC Name: 3-hydroxy-2-propan-2-ylbenzenesulfonic acid Traditional Name: 3-hydroxy-2-isopropyl-besylic acid Formula: C9H12O4S MolecularWeight: 216.25418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC=C1S(=O)(=O)O)O

Isomeric SMILES

CC(C)C1=C(C=CC=C1S(=O)(=O)O)O

InChI

InChI=1S/C9H12O4S/c1-6(2)9-7(10)4-3-5-8(9)14(11,12)13/h3-6,10H,1-2H3,(H,11,12,13)