2-phenylpropan-2-yl 2-octylbenzenesulfonate

Systemtic Name: 2-phenylpropan-2-yl 2-octylbenzenesulfonate Openeye Name: (1-methyl-1-phenyl-ethyl) 2-octylbenzenesulfonate CAS Name: 2-octylbenzenesulfonic acid 2-phenylpropan-2-yl ester IUPAC Name: 2-phenylpropan-2-yl 2-octylbenzenesulfonate Traditional Name: 2-octylbenzenesulfonic acid cumyl ester Formula: C23H32O3S MolecularWeight: 388.56338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC=C1S(=O)(=O)OC(C)(C)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCC1=CC=CC=C1S(=O)(=O)OC(C)(C)C2=CC=CC=C2

InChI

InChI=1S/C23H32O3S/c1-4-5-6-7-8-10-15-20-16-13-14-19-22(20)27(24,25)26-23(2,3)21-17-11-9-12-18-21/h9,11-14,16-19H,4-8,10,15H2,1-3H3