[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 3-(trifluoromethyloxy)benzenesulfonate

Systemtic Name: [4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 3-(trifluoromethyloxy)benzenesulfonate Openeye Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 3-(trifluoromethoxy)benzenesulfonate CAS Name: 3-(trifluoromethoxy)benzenesulfonic acid [4-(2-oxo-1-pyrrolidinyl)phenyl] ester IUPAC Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 3-(trifluoromethoxy)benzenesulfonate Traditional Name: 3-(trifluoromethoxy)benzenesulfonic acid [4-(2-ketopyrrolidino)phenyl] ester Formula: C17H14F3NO5S MolecularWeight: 401.35697

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)OC(F)(F)F

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)OC(F)(F)F

InChI

InChI=1S/C17H14F3NO5S/c18-17(19,20)25-14-3-1-4-15(11-14)27(23,24)26-13-8-6-12(7-9-13)21-10-2-5-16(21)22/h1,3-4,6-9,11H,2,5,10H2