1,3-bis(2-chloroethyl)benzimidazol-3-ium bromide

Systemtic Name: 1,3-bis(2-chloroethyl)benzimidazol-3-ium bromide Openeye Name: 1,3-bis(2-chloroethyl)benzimidazol-3-ium bromide CAS Name: 1,3-bis(2-chloroethyl)benzimidazol-3-ium bromide IUPAC Name: 1,3-bis(2-chloroethyl)benzimidazol-3-ium bromide Traditional Name: 1,3-bis(2-chloroethyl)benzimidazol-3-ium bromide Formula: C11H13BrCl2N2 MolecularWeight: 324.04432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C=[N+]2CCCl)CCCl.[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)N(C=[N+]2CCCl)CCCl.[Br-]

InChI

InChI=1S/C11H13Cl2N2.BrH/c12-5-7-14-9-15(8-6-13)11-4-2-1-3-10(11)14;/h1-4,9H,5-8H2;1H/q+1;/p-1