3-(3-fluoranyl-4-methyl-phenyl)-1H-benzimidazol-3-ium-2-amine

Systemtic Name: 3-(3-fluoranyl-4-methyl-phenyl)-1H-benzimidazol-3-ium-2-amine Openeye Name: 3-(3-fluoro-4-methyl-phenyl)-1H-benzimidazol-3-ium-2-amine CAS Name: 3-(3-fluoro-4-methylphenyl)-1H-benzimidazol-3-ium-2-amine IUPAC Name: 3-(3-fluoro-4-methylphenyl)-1H-benzimidazol-3-ium-2-amine Traditional Name: [3-(3-fluoro-4-methyl-phenyl)-1H-benzimidazol-3-ium-2-yl]amine Formula: C14H13FN3+ MolecularWeight: 242.271523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+]2=C(NC3=CC=CC=C32)N)F

Isomeric SMILES

CC1=C(C=C(C=C1)[N+]2=C(NC3=CC=CC=C32)N)F

InChI

InChI=1S/C14H12FN3/c1-9-6-7-10(8-11(9)15)18-13-5-3-2-4-12(13)17-14(18)16/h2-8H,1H3,(H2,16,17)/p+1