(2-acetamidophenyl) 4-tert-butylbenzenesulfonate

Systemtic Name: (2-acetamidophenyl) 4-tert-butylbenzenesulfonate Openeye Name: (2-acetamidophenyl) 4-tert-butylbenzenesulfonate CAS Name: 4-tert-butylbenzenesulfonic acid (2-acetamidophenyl) ester IUPAC Name: (2-acetamidophenyl) 4-tert-butylbenzenesulfonate Traditional Name: 4-tert-butylbenzenesulfonic acid (2-acetamidophenyl) ester Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1OS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(=O)NC1=CC=CC=C1OS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C18H21NO4S/c1-13(20)19-16-7-5-6-8-17(16)23-24(21,22)15-11-9-14(10-12-15)18(2,3)4/h5-12H,1-4H3,(H,19,20)