2,2-dimethylpropyl 4-butan-2-ylbenzenesulfonate

Systemtic Name: 2,2-dimethylpropyl 4-butan-2-ylbenzenesulfonate Openeye Name: 2,2-dimethylpropyl 4-sec-butylbenzenesulfonate CAS Name: 4-butan-2-ylbenzenesulfonic acid 2,2-dimethylpropyl ester IUPAC Name: 2,2-dimethylpropyl 4-butan-2-ylbenzenesulfonate Traditional Name: 4-sec-butylbenzenesulfonic acid neopentyl ester Formula: C15H24O3S MolecularWeight: 284.41426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24O3S/c1-6-12(2)13-7-9-14(10-8-13)19(16,17)18-11-15(3,4)5/h7-10,12H,6,11H2,1-5H3