1-[(E)-1-(3H-benzimidazol-1-ium-1-yl)-2-bromanyl-2-chloranyl-ethenyl]benzimidazole

Systemtic Name: 1-[(E)-1-(3H-benzimidazol-1-ium-1-yl)-2-bromanyl-2-chloranyl-ethenyl]benzimidazole Openeye Name: 1-[(E)-1-(3H-benzimidazol-1-ium-1-yl)-2-bromo-2-chloro-vinyl]benzimidazole CAS Name: 1-[(E)-1-(3H-benzimidazol-1-ium-1-yl)-2-bromo-2-chloroethenyl]benzimidazole IUPAC Name: 1-[(E)-1-(3H-benzimidazol-1-ium-1-yl)-2-bromo-2-chloroethenyl]benzimidazole Traditional Name: 1-[(E)-1-(3H-benzimidazol-1-ium-1-yl)-2-bromo-2-chloro-vinyl]benzimidazole Formula: C16H11BrClN4+ MolecularWeight: 374.64234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC=[N+]2C(=C(Cl)Br)N3C=NC4=CC=CC=C43

Isomeric SMILES

C1=CC=C2C(=C1)NC=[N+]2/C(=C(\Cl)/Br)/N3C=NC4=CC=CC=C43

InChI

InChI=1S/C16H10BrClN4/c17-15(18)16(21-9-19-11-5-1-3-7-13(11)21)22-10-20-12-6-2-4-8-14(12)22/h1-10H/p+1