3-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-1H-benzimidazol-3-ium-2-amine

Systemtic Name: 3-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-1H-benzimidazol-3-ium-2-amine Openeye Name: 3-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-benzimidazol-3-ium-2-amine CAS Name: 3-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-benzimidazol-3-ium-2-amine IUPAC Name: 3-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-benzimidazol-3-ium-2-amine Traditional Name: [3-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-benzimidazol-3-ium-2-yl]amine Formula: C14H10F2N3O2+ MolecularWeight: 290.244906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=[N+]2C3=CC4=C(C=C3)OC(O4)(F)F)N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=[N+]2C3=CC4=C(C=C3)OC(O4)(F)F)N

InChI

InChI=1S/C14H9F2N3O2/c15-14(16)20-11-6-5-8(7-12(11)21-14)19-10-4-2-1-3-9(10)18-13(19)17/h1-7H,(H2,17,18)/p+1