N-[3,5-bis(trifluoromethyl)phenyl]-4-(5-oxidanylidenepyrrolidin-3-yl)benzenesulfonamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(5-oxidanylidenepyrrolidin-3-yl)benzenesulfonamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(5-oxopyrrolidin-3-yl)benzenesulfonamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(5-oxo-3-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(5-oxopyrrolidin-3-yl)benzenesulfonamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(5-ketopyrrolidin-3-yl)benzenesulfonamide Formula: C18H14F6N2O3S MolecularWeight: 452.370779

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1C(CNC1=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H14F6N2O3S/c19-17(20,21)12-6-13(18(22,23)24)8-14(7-12)26-30(28,29)15-3-1-10(2-4-15)11-5-16(27)25-9-11/h1-4,6-8,11,26H,5,9H2,(H,25,27)