3,5-bis(chloranyl)-2-[4-methoxy-1-propyl-2-(trifluoromethyl)benzimidazol-1-ium-1-yl]pyridine-4-carboxamide

Systemtic Name: 3,5-bis(chloranyl)-2-[4-methoxy-1-propyl-2-(trifluoromethyl)benzimidazol-1-ium-1-yl]pyridine-4-carboxamide Openeye Name: 3,5-dichloro-2-[4-methoxy-1-propyl-2-(trifluoromethyl)benzimidazol-1-ium-1-yl]pyridine-4-carboxamide CAS Name: 3,5-dichloro-2-[4-methoxy-1-propyl-2-(trifluoromethyl)-1-benzimidazol-1-iumyl]-4-pyridinecarboxamide IUPAC Name: 3,5-dichloro-2-[4-methoxy-1-propyl-2-(trifluoromethyl)benzimidazol-1-ium-1-yl]pyridine-4-carboxamide Traditional Name: 3,5-dichloro-2-[4-methoxy-1-propyl-2-(trifluoromethyl)benzimidazol-1-ium-1-yl]isonicotinamide Formula: C18H16Cl2F3N4O2+ MolecularWeight: 448.24645

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1(C2=C(C(=CC=C2)OC)N=C1C(F)(F)F)C3=NC=C(C(=C3Cl)C(=O)N)Cl

Isomeric SMILES

CCC[N+]1(C2=C(C(=CC=C2)OC)N=C1C(F)(F)F)C3=NC=C(C(=C3Cl)C(=O)N)Cl

InChI

InChI=1S/C18H15Cl2F3N4O2/c1-3-7-27(16-13(20)12(15(24)28)9(19)8-25-16)10-5-4-6-11(29-2)14(10)26-17(27)18(21,22)23/h4-6,8H,3,7H2,1-2H3,(H-,24,28)/p+1