2-methylpropyl benzenesulfonate

Systemtic Name: 2-methylpropyl benzenesulfonate Openeye Name: isobutyl benzenesulfonate CAS Name: benzenesulfonic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl benzenesulfonate Traditional Name: benzenesulfonic acid isobutyl ester Formula: C10H14O3S MolecularWeight: 214.28136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O3S/c1-9(2)8-13-14(11,12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3