4-tert-butyl-2,6-dimethyl-benzenesulfonic acid

Systemtic Name: 4-tert-butyl-2,6-dimethyl-benzenesulfonic acid Openeye Name: 4-tert-butyl-2,6-dimethyl-benzenesulfonic acid CAS Name: 4-tert-butyl-2,6-dimethylbenzenesulfonic acid IUPAC Name: 4-tert-butyl-2,6-dimethylbenzenesulfonic acid Traditional Name: 4-tert-butyl-2,6-dimethyl-besylic acid Formula: C12H18O3S MolecularWeight: 242.33452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)O)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)O)C)C(C)(C)C

InChI

InChI=1S/C12H18O3S/c1-8-6-10(12(3,4)5)7-9(2)11(8)16(13,14)15/h6-7H,1-5H3,(H,13,14,15)