2-methylpropyl 3-tert-butylbenzenesulfonate

Systemtic Name: 2-methylpropyl 3-tert-butylbenzenesulfonate Openeye Name: isobutyl 3-tert-butylbenzenesulfonate CAS Name: 3-tert-butylbenzenesulfonic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-tert-butylbenzenesulfonate Traditional Name: 3-tert-butylbenzenesulfonic acid isobutyl ester Formula: C14H22O3S MolecularWeight: 270.38768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COS(=O)(=O)C1=CC=CC(=C1)C(C)(C)C

Isomeric SMILES

CC(C)COS(=O)(=O)C1=CC=CC(=C1)C(C)(C)C

InChI

InChI=1S/C14H22O3S/c1-11(2)10-17-18(15,16)13-8-6-7-12(9-13)14(3,4)5/h6-9,11H,10H2,1-5H3