(4-tert-butyl-2-chloranyl-phenyl) 4-methylbenzenesulfonate

Systemtic Name: (4-tert-butyl-2-chloranyl-phenyl) 4-methylbenzenesulfonate Openeye Name: (4-tert-butyl-2-chloro-phenyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-tert-butyl-2-chlorophenyl) ester IUPAC Name: (4-tert-butyl-2-chlorophenyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-tert-butyl-2-chloro-phenyl) ester Formula: C17H19ClO3S MolecularWeight: 338.84896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClO3S/c1-12-5-8-14(9-6-12)22(19,20)21-16-10-7-13(11-15(16)18)17(2,3)4/h5-11H,1-4H3