[4,5-bis[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-carboxy-diethyl-azanium

Systemtic Name: [4,5-bis[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-carboxy-diethyl-azanium Openeye Name: [4,5-bis[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-carboxy-diethyl-ammonium CAS Name: [4,5-bis[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-carboxy-diethylammonium IUPAC Name: [4,5-bis[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-carboxy-diethylazanium Traditional Name: [4,5-bis[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-carboxy-diethyl-ammonium Formula: C22H20F6N3O2+ MolecularWeight: 472.403519

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(C1=NC(=C(N1)C2=CC=C(C=C2)C(F)(F)F)C3=CC=C(C=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

CC[N+](CC)(C1=NC(=C(N1)C2=CC=C(C=C2)C(F)(F)F)C3=CC=C(C=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C22H19F6N3O2/c1-3-31(4-2,20(32)33)19-29-17(13-5-9-15(10-6-13)21(23,24)25)18(30-19)14-7-11-16(12-8-14)22(26,27)28/h5-12H,3-4H2,1-2H3,(H-,29,30,32,33)/p+1