3-(1,3-benzodioxol-5-yl)-1H-benzimidazol-3-ium-2-amine

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1H-benzimidazol-3-ium-2-amine Openeye Name: 3-(1,3-benzodioxol-5-yl)-1H-benzimidazol-3-ium-2-amine CAS Name: 3-(1,3-benzodioxol-5-yl)-1H-benzimidazol-3-ium-2-amine IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1H-benzimidazol-3-ium-2-amine Traditional Name: [3-(1,3-benzodioxol-5-yl)-1H-benzimidazol-3-ium-2-yl]amine Formula: C14H12N3O2+ MolecularWeight: 254.26398

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)[N+]3=C(NC4=CC=CC=C43)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)[N+]3=C(NC4=CC=CC=C43)N

InChI

InChI=1S/C14H11N3O2/c15-14-16-10-3-1-2-4-11(10)17(14)9-5-6-12-13(7-9)19-8-18-12/h1-7H,8H2,(H2,15,16)/p+1