(4S)-4-benzamido-1-(3,4-dimethylphenyl)-5-oxidanylidene-4-(trifluoromethyl)imidazol-2-olate

Systemtic Name: (4S)-4-benzamido-1-(3,4-dimethylphenyl)-5-oxidanylidene-4-(trifluoromethyl)imidazol-2-olate Openeye Name: (4S)-4-benzamido-1-(3,4-dimethylphenyl)-5-oxo-4-(trifluoromethyl)imidazol-2-olate CAS Name: (4S)-4-benzamido-1-(3,4-dimethylphenyl)-5-oxo-4-(trifluoromethyl)-2-imidazololate IUPAC Name: (4S)-4-benzamido-1-(3,4-dimethylphenyl)-5-oxo-4-(trifluoromethyl)imidazol-2-olate Traditional Name: (4S)-4-benzamido-1-(3,4-dimethylphenyl)-5-keto-4-(trifluoromethyl)-2-imidazolin-2-olate Formula: C19H15F3N3O3- MolecularWeight: 390.33591

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(N=C2[O-])(C(F)(F)F)NC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)[C@](N=C2[O-])(C(F)(F)F)NC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C19H16F3N3O3/c1-11-8-9-14(10-12(11)2)25-16(27)18(19(20,21)22,24-17(25)28)23-15(26)13-6-4-3-5-7-13/h3-10H,1-2H3,(H,23,26)(H,24,28)/p-1/t18-/m0/s1