3-methyl-N-[(4S)-5-oxidanylidene-2-phenyl-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl]butanamide

Systemtic Name: 3-methyl-N-[(4S)-5-oxidanylidene-2-phenyl-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl]butanamide Openeye Name: 3-methyl-N-[(4S)-5-oxo-2-phenyl-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl]butanamide CAS Name: 3-methyl-N-[(4S)-5-oxo-2-phenyl-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl]butanamide IUPAC Name: 3-methyl-N-[(4S)-5-oxo-2-phenyl-4-(trifluoromethyl)-1H-imidazol-3-ium-4-yl]butanamide Traditional Name: N-[(4S)-5-keto-2-phenyl-4-(trifluoromethyl)-2-imidazolin-3-ium-4-yl]-3-methyl-butyramide Formula: C15H17F3N3O2+ MolecularWeight: 328.30959

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1(C(=O)NC(=[NH+]1)C2=CC=CC=C2)C(F)(F)F

Isomeric SMILES

CC(C)CC(=O)N[C@]1(C(=O)NC(=[NH+]1)C2=CC=CC=C2)C(F)(F)F

InChI

InChI=1S/C15H16F3N3O2/c1-9(2)8-11(22)20-14(15(16,17)18)13(23)19-12(21-14)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,20,22)(H,19,21,23)/p+1/t14-/m0/s1