(2,2-dimethyl-3-phenyl-propyl) 4-tert-butylbenzenesulfonate

Systemtic Name: (2,2-dimethyl-3-phenyl-propyl) 4-tert-butylbenzenesulfonate Openeye Name: (2,2-dimethyl-3-phenyl-propyl) 4-tert-butylbenzenesulfonate CAS Name: 4-tert-butylbenzenesulfonic acid (2,2-dimethyl-3-phenylpropyl) ester IUPAC Name: (2,2-dimethyl-3-phenylpropyl) 4-tert-butylbenzenesulfonate Traditional Name: 4-tert-butylbenzenesulfonic acid (2,2-dimethyl-3-phenyl-propyl) ester Formula: C21H28O3S MolecularWeight: 360.51022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)OCC(C)(C)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)OCC(C)(C)CC2=CC=CC=C2

InChI

InChI=1S/C21H28O3S/c1-20(2,3)18-11-13-19(14-12-18)25(22,23)24-16-21(4,5)15-17-9-7-6-8-10-17/h6-14H,15-16H2,1-5H3