4-(2-methylpent-3-yn-2-yloxy)benzenesulfonic acid

Systemtic Name: 4-(2-methylpent-3-yn-2-yloxy)benzenesulfonic acid Openeye Name: 4-(1,1-dimethylbut-2-ynoxy)benzenesulfonic acid CAS Name: 4-(2-methylpent-3-yn-2-yloxy)benzenesulfonic acid IUPAC Name: 4-(2-methylpent-3-yn-2-yloxy)benzenesulfonic acid Traditional Name: 4-(1,1-dimethylbut-2-ynoxy)besylic acid Formula: C12H14O4S MolecularWeight: 254.30216

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(C)(C)OC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CC#CC(C)(C)OC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C12H14O4S/c1-4-9-12(2,3)16-10-5-7-11(8-6-10)17(13,14)15/h5-8H,1-3H3,(H,13,14,15)