4-(2-methylbutan-2-yl)benzenesulfonic acid

Systemtic Name: 4-(2-methylbutan-2-yl)benzenesulfonic acid Openeye Name: 4-(1,1-dimethylpropyl)benzenesulfonic acid CAS Name: 4-(2-methylbutan-2-yl)benzenesulfonic acid IUPAC Name: 4-(2-methylbutan-2-yl)benzenesulfonic acid Traditional Name: 4-tert-amylbesylic acid Formula: C11H16O3S MolecularWeight: 228.30794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16O3S/c1-4-11(2,3)9-5-7-10(8-6-9)15(12,13)14/h5-8H,4H2,1-3H3,(H,12,13,14)