N-[3-[2-(4-bromophenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]propyl]cyclohexanamine

Systemtic Name: N-[3-[2-(4-bromophenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]propyl]cyclohexanamine Openeye Name: N-[3-[2-(4-bromophenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]propyl]cyclohexanamine CAS Name: N-[3-[2-(4-bromophenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]propyl]cyclohexanamine IUPAC Name: N-[3-[2-(4-bromophenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]propyl]cyclohexanamine Traditional Name: 3-[2-(4-bromophenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]propyl-cyclohexyl-amine Formula: C24H28BrN4+ MolecularWeight: 452.40992

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NCCCN2C(=C[N+]3=C2NC4=CC=CC=C43)C5=CC=C(C=C5)Br

Isomeric SMILES

C1CCC(CC1)NCCCN2C(=C[N+]3=C2NC4=CC=CC=C43)C5=CC=C(C=C5)Br

InChI

InChI=1S/C24H27BrN4/c25-19-13-11-18(12-14-19)23-17-29-22-10-5-4-9-21(22)27-24(29)28(23)16-6-15-26-20-7-2-1-3-8-20/h4-5,9-14,17,20,26H,1-3,6-8,15-16H2/p+1