5,6-bis(chloranyl)-1-(2-chloroethyl)-3-ethyl-2-methyl-benzimidazol-1-ium iodide

Systemtic Name: 5,6-bis(chloranyl)-1-(2-chloroethyl)-3-ethyl-2-methyl-benzimidazol-1-ium iodide Openeye Name: 5,6-dichloro-1-(2-chloroethyl)-3-ethyl-2-methyl-benzimidazol-1-ium iodide CAS Name: 5,6-dichloro-1-(2-chloroethyl)-3-ethyl-2-methylbenzimidazol-1-ium iodide IUPAC Name: 5,6-dichloro-1-(2-chloroethyl)-3-ethyl-2-methylbenzimidazol-1-ium iodide Traditional Name: 5,6-dichloro-1-(2-chloroethyl)-3-ethyl-2-methyl-benzimidazol-1-ium iodide Formula: C12H14Cl3IN2 MolecularWeight: 419.51643

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=[N+](C2=CC(=C(C=C21)Cl)Cl)CCCl)C.[I-]

Isomeric SMILES

CCN1C(=[N+](C2=CC(=C(C=C21)Cl)Cl)CCCl)C.[I-]

InChI

InChI=1S/C12H14Cl3N2.HI/c1-3-16-8(2)17(5-4-13)12-7-10(15)9(14)6-11(12)16;/h6-7H,3-5H2,1-2H3;1H/q+1;/p-1