1-oxidanidyl-N-[5-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-oxidanidyl-N-[5-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]pyridin-1-ium-3-carboxamide Openeye Name: 1-oxido-N-[5-oxo-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]pyridin-1-ium-3-carboxamide CAS Name: 1-oxido-N-[5-oxo-1-[[2-(trifluoromethyl)phenyl]methyl]-3-pyrrolidinyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-oxido-N-[5-oxo-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]pyridin-1-ium-3-carboxamide Traditional Name: N-[5-keto-1-[2-(trifluoromethyl)benzyl]pyrrolidin-3-yl]-1-oxido-pyridin-1-ium-3-carboxamide Formula: C18H16F3N3O3 MolecularWeight: 379.33315

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CC2=CC=CC=C2C(F)(F)F)NC(=O)C3=C[N+](=CC=C3)[O-]

Isomeric SMILES

C1C(CN(C1=O)CC2=CC=CC=C2C(F)(F)F)NC(=O)C3=C[N+](=CC=C3)[O-]

InChI

InChI=1S/C18H16F3N3O3/c19-18(20,21)15-6-2-1-4-12(15)9-23-11-14(8-16(23)25)22-17(26)13-5-3-7-24(27)10-13/h1-7,10,14H,8-9,11H2,(H,22,26)