1-oxidanidyl-N-[(3R)-5-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]pyridin-1-ium-4-carboxamide

Systemtic Name: 1-oxidanidyl-N-[(3R)-5-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]pyridin-1-ium-4-carboxamide Openeye Name: 1-oxido-N-[(3R)-5-oxo-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]pyridin-1-ium-4-carboxamide CAS Name: 1-oxido-N-[(3R)-5-oxo-1-[[2-(trifluoromethyl)phenyl]methyl]-3-pyrrolidinyl]-4-pyridin-1-iumcarboxamide IUPAC Name: 1-oxido-N-[(3R)-5-oxo-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]pyridin-1-ium-4-carboxamide Traditional Name: N-[(3R)-5-keto-1-[2-(trifluoromethyl)benzyl]pyrrolidin-3-yl]-1-oxido-pyridin-1-ium-4-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=CC=[N+](C=C3)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H16F3N3O3/c19-18(20,21)15-4-2-1-3-13(15)10-23-11-14(9-16(23)25)22-17(26)12-5-7-24(27)8-6-12/h1-8,14H,9-11H2,(H,22,26)/t14-/m1/s1