2-phenylbutan-2-yl 2-octylbenzenesulfonate

Systemtic Name: 2-phenylbutan-2-yl 2-octylbenzenesulfonate Openeye Name: (1-methyl-1-phenyl-propyl) 2-octylbenzenesulfonate CAS Name: 2-octylbenzenesulfonic acid 2-phenylbutan-2-yl ester IUPAC Name: 2-phenylbutan-2-yl 2-octylbenzenesulfonate Traditional Name: 2-octylbenzenesulfonic acid (1-methyl-1-phenyl-propyl) ester Formula: C24H34O3S MolecularWeight: 402.58996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H34O3S/c1-4-6-7-8-9-11-16-21-17-14-15-20-23(21)28(25,26)27-24(3,5-2)22-18-12-10-13-19-22/h10,12-15,17-20H,4-9,11,16H2,1-3H3