(2R)-N-[4-azanyl-3-(trifluoromethyl)phenyl]-2-(1H-imidazol-3-ium-3-yl)propanamide

Systemtic Name: (2R)-N-[4-azanyl-3-(trifluoromethyl)phenyl]-2-(1H-imidazol-3-ium-3-yl)propanamide Openeye Name: (2R)-N-[4-amino-3-(trifluoromethyl)phenyl]-2-(1H-imidazol-3-ium-3-yl)propanamide CAS Name: (2R)-N-[4-amino-3-(trifluoromethyl)phenyl]-2-(1H-imidazol-3-ium-3-yl)propanamide IUPAC Name: (2R)-N-[4-amino-3-(trifluoromethyl)phenyl]-2-(1H-imidazol-3-ium-3-yl)propanamide Traditional Name: (2R)-N-[4-amino-3-(trifluoromethyl)phenyl]-2-(1H-imidazol-3-ium-3-yl)propionamide Formula: C13H14F3N4O+ MolecularWeight: 299.27167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)N)C(F)(F)F)[N+]2=CNC=C2

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=C(C=C1)N)C(F)(F)F)[N+]2=CNC=C2

InChI

InChI=1S/C13H13F3N4O/c1-8(20-5-4-18-7-20)12(21)19-9-2-3-11(17)10(6-9)13(14,15)16/h2-8H,17H2,1H3,(H,19,21)/p+1/t8-/m1/s1