(2-methyl-2-oxidanyl-propyl) 4-butan-2-ylbenzenesulfonate

Systemtic Name: (2-methyl-2-oxidanyl-propyl) 4-butan-2-ylbenzenesulfonate Openeye Name: (2-hydroxy-2-methyl-propyl) 4-sec-butylbenzenesulfonate CAS Name: 4-butan-2-ylbenzenesulfonic acid (2-hydroxy-2-methylpropyl) ester IUPAC Name: (2-hydroxy-2-methylpropyl) 4-butan-2-ylbenzenesulfonate Traditional Name: 4-sec-butylbenzenesulfonic acid (2-hydroxy-2-methyl-propyl) ester Formula: C14H22O4S MolecularWeight: 286.38708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22O4S/c1-5-11(2)12-6-8-13(9-7-12)19(16,17)18-10-14(3,4)15/h6-9,11,15H,5,10H2,1-4H3