2,2-dimethylpropyl (4-methylphenyl)methanesulfonate

Systemtic Name: 2,2-dimethylpropyl (4-methylphenyl)methanesulfonate Openeye Name: 2,2-dimethylpropyl p-tolylmethanesulfonate CAS Name: (4-methylphenyl)methanesulfonic acid 2,2-dimethylpropyl ester IUPAC Name: 2,2-dimethylpropyl (4-methylphenyl)methanesulfonate Traditional Name: p-tolylmethanesulfonic acid neopentyl ester Formula: C13H20O3S MolecularWeight: 256.3611

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)OCC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)OCC(C)(C)C

InChI

InChI=1S/C13H20O3S/c1-11-5-7-12(8-6-11)9-17(14,15)16-10-13(2,3)4/h5-8H,9-10H2,1-4H3