3-methoxy-N-[(5S)-4-oxidanylidene-2-phenyl-3-propan-2-yl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide

Systemtic Name: 3-methoxy-N-[(5S)-4-oxidanylidene-2-phenyl-3-propan-2-yl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide Openeye Name: N-[(5S)-3-isopropyl-4-oxo-2-phenyl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]-3-methoxy-benzamide CAS Name: 3-methoxy-N-[(5S)-4-oxo-2-phenyl-3-propan-2-yl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide IUPAC Name: 3-methoxy-N-[(5S)-4-oxo-2-phenyl-3-propan-2-yl-5-(trifluoromethyl)-1H-imidazol-3-ium-5-yl]benzamide Traditional Name: N-[(4S)-1-isopropyl-5-keto-2-phenyl-4-(trifluoromethyl)-2-imidazolin-1-ium-4-yl]-3-methoxy-benzamide Formula: C21H21F3N3O3+ MolecularWeight: 420.40495

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=C(NC(C1=O)(C(F)(F)F)NC(=O)C2=CC(=CC=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C)[N+]1=C(N[C@](C1=O)(C(F)(F)F)NC(=O)C2=CC(=CC=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H20F3N3O3/c1-13(2)27-17(14-8-5-4-6-9-14)25-20(19(27)29,21(22,23)24)26-18(28)15-10-7-11-16(12-15)30-3/h4-13H,1-3H3,(H,26,28)/p+1/t20-/m0/s1