(2-fluorophenyl) 4-(2,2-dimethylpropanoylamino)benzenesulfonate

Systemtic Name: (2-fluorophenyl) 4-(2,2-dimethylpropanoylamino)benzenesulfonate Openeye Name: (2-fluorophenyl) 4-(2,2-dimethylpropanoylamino)benzenesulfonate CAS Name: 4-[(2,2-dimethyl-1-oxopropyl)amino]benzenesulfonic acid (2-fluorophenyl) ester IUPAC Name: (2-fluorophenyl) 4-(2,2-dimethylpropanoylamino)benzenesulfonate Traditional Name: 4-(pivaloylamino)benzenesulfonic acid (2-fluorophenyl) ester Formula: C17H18FNO4S MolecularWeight: 351.392523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2F

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2F

InChI

InChI=1S/C17H18FNO4S/c1-17(2,3)16(20)19-12-8-10-13(11-9-12)24(21,22)23-15-7-5-4-6-14(15)18/h4-11H,1-3H3,(H,19,20)