1H-imidazol-2-ylmethyl-[(3R)-5-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]azanium

Systemtic Name: 1H-imidazol-2-ylmethyl-[(3R)-5-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]azanium Openeye Name: 1H-imidazol-2-ylmethyl-[(3R)-5-oxo-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]ammonium CAS Name: 1H-imidazol-2-ylmethyl-[(3R)-5-oxo-1-[[2-(trifluoromethyl)phenyl]methyl]-3-pyrrolidinyl]ammonium IUPAC Name: 1H-imidazol-2-ylmethyl-[(3R)-5-oxo-1-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]azanium Traditional Name: 1H-imidazol-2-ylmethyl-[(3R)-5-keto-1-[2-(trifluoromethyl)benzyl]pyrrolidin-3-yl]ammonium Formula: C16H18F3N4O+ MolecularWeight: 339.33553

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CC2=CC=CC=C2C(F)(F)F)[NH2+]CC3=NC=CN3

Isomeric SMILES

C1[C@H](CN(C1=O)CC2=CC=CC=C2C(F)(F)F)[NH2+]CC3=NC=CN3

InChI

InChI=1S/C16H17F3N4O/c17-16(18,19)13-4-2-1-3-11(13)9-23-10-12(7-15(23)24)22-8-14-20-5-6-21-14/h1-6,12,22H,7-10H2,(H,20,21)/p+1/t12-/m1/s1