(2-cyanophenyl) 4-tert-butylbenzenesulfonate

Systemtic Name: (2-cyanophenyl) 4-tert-butylbenzenesulfonate Openeye Name: (2-cyanophenyl) 4-tert-butylbenzenesulfonate CAS Name: 4-tert-butylbenzenesulfonic acid (2-cyanophenyl) ester IUPAC Name: (2-cyanophenyl) 4-tert-butylbenzenesulfonate Traditional Name: 4-tert-butylbenzenesulfonic acid (2-cyanophenyl) ester Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C#N

InChI

InChI=1S/C17H17NO3S/c1-17(2,3)14-8-10-15(11-9-14)22(19,20)21-16-7-5-4-6-13(16)12-18/h4-11H,1-3H3