N-[(4S)-2-(4-methylphenyl)-5-oxidanylidene-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl]ethanamide

Systemtic Name: N-[(4S)-2-(4-methylphenyl)-5-oxidanylidene-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl]ethanamide Openeye Name: N-[(4S)-5-oxo-2-(p-tolyl)-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl]acetamide CAS Name: N-[(4S)-2-(4-methylphenyl)-5-oxo-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl]acetamide IUPAC Name: N-[(4S)-2-(4-methylphenyl)-5-oxo-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl]acetamide Traditional Name: N-[(4S)-5-keto-2-(p-tolyl)-4-(trifluoromethyl)-2-imidazolin-3-ium-4-yl]acetamide Formula: C13H13F3N3O2+ MolecularWeight: 300.25643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=[NH+]C(C(=O)N2)(C(F)(F)F)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=[NH+][C@@](C(=O)N2)(C(F)(F)F)NC(=O)C

InChI

InChI=1S/C13H12F3N3O2/c1-7-3-5-9(6-4-7)10-17-11(21)12(19-10,13(14,15)16)18-8(2)20/h3-6H,1-2H3,(H,18,20)(H,17,19,21)/p+1/t12-/m0/s1