2-[1-(4-bromophenyl)indazol-3-yl]-1,3-dimethyl-benzimidazol-3-ium tetrafluoroborate

Systemtic Name: 2-[1-(4-bromophenyl)indazol-3-yl]-1,3-dimethyl-benzimidazol-3-ium tetrafluoroborate Openeye Name: 2-[1-(4-bromophenyl)indazol-3-yl]-1,3-dimethyl-benzimidazol-3-ium tetrafluoroborate CAS Name: 2-[1-(4-bromophenyl)-3-indazolyl]-1,3-dimethylbenzimidazol-3-ium tetrafluoroborate IUPAC Name: 2-[1-(4-bromophenyl)indazol-3-yl]-1,3-dimethylbenzimidazol-3-ium tetrafluoroborate Traditional Name: 2-[1-(4-bromophenyl)indazol-3-yl]-1,3-dimethyl-benzimidazol-3-ium tetrafluoroborate Formula: C22H18BBrF4N4 MolecularWeight: 505.113733

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CN1C2=CC=CC=C2[N+](=C1C3=NN(C4=CC=CC=C43)C5=CC=C(C=C5)Br)C

Isomeric SMILES

[B-](F)(F)(F)F.CN1C2=CC=CC=C2[N+](=C1C3=NN(C4=CC=CC=C43)C5=CC=C(C=C5)Br)C

InChI

InChI=1S/C22H18BrN4.BF4/c1-25-19-9-5-6-10-20(19)26(2)22(25)21-17-7-3-4-8-18(17)27(24-21)16-13-11-15(23)12-14-16;2-1(3,4)5/h3-14H,1-2H3;/q+1;-1