bis[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-[[4-(trifluoromethyl)phenyl]methyl]azanium

Systemtic Name: bis[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-[[4-(trifluoromethyl)phenyl]methyl]azanium Openeye Name: bis[2-(2,6-dimethylanilino)-2-oxo-ethyl]-[[4-(trifluoromethyl)phenyl]methyl]ammonium CAS Name: bis[2-(2,6-dimethylanilino)-2-oxoethyl]-[[4-(trifluoromethyl)phenyl]methyl]ammonium IUPAC Name: bis[2-(2,6-dimethylanilino)-2-oxoethyl]-[[4-(trifluoromethyl)phenyl]methyl]azanium Traditional Name: bis[2-(2,6-dimethylanilino)-2-keto-ethyl]-[4-(trifluoromethyl)benzyl]ammonium Formula: C28H31F3N3O2+ MolecularWeight: 498.55985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+](CC2=CC=C(C=C2)C(F)(F)F)CC(=O)NC3=C(C=CC=C3C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+](CC2=CC=C(C=C2)C(F)(F)F)CC(=O)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C28H30F3N3O2/c1-18-7-5-8-19(2)26(18)32-24(35)16-34(15-22-11-13-23(14-12-22)28(29,30)31)17-25(36)33-27-20(3)9-6-10-21(27)4/h5-14H,15-17H2,1-4H3,(H,32,35)(H,33,36)/p+1