(3,5-ditert-butylphenyl) 4-methylbenzenesulfonate

Systemtic Name: (3,5-ditert-butylphenyl) 4-methylbenzenesulfonate Openeye Name: (3,5-ditert-butylphenyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (3,5-ditert-butylphenyl) ester IUPAC Name: (3,5-ditert-butylphenyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3,5-ditert-butylphenyl) ester Formula: C21H28O3S MolecularWeight: 360.51022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C21H28O3S/c1-15-8-10-19(11-9-15)25(22,23)24-18-13-16(20(2,3)4)12-17(14-18)21(5,6)7/h8-14H,1-7H3