N-[4-[5,6-bis(chloranyl)-3-ethyl-2-methyl-benzimidazol-1-ium-1-yl]butylsulfonyl]ethanamide bromide

Systemtic Name: N-[4-[5,6-bis(chloranyl)-3-ethyl-2-methyl-benzimidazol-1-ium-1-yl]butylsulfonyl]ethanamide bromide Openeye Name: N-[4-(5,6-dichloro-3-ethyl-2-methyl-benzimidazol-1-ium-1-yl)butylsulfonyl]acetamide bromide CAS Name: N-[4-(5,6-dichloro-3-ethyl-2-methyl-1-benzimidazol-1-iumyl)butylsulfonyl]acetamide bromide IUPAC Name: N-[4-(5,6-dichloro-3-ethyl-2-methylbenzimidazol-1-ium-1-yl)butylsulfonyl]acetamide bromide Traditional Name: N-[4-(5,6-dichloro-3-ethyl-2-methyl-benzimidazol-1-ium-1-yl)butylsulfonyl]acetamide bromide Formula: C16H22BrCl2N3O3S MolecularWeight: 487.23918

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=[N+](C2=CC(=C(C=C21)Cl)Cl)CCCCS(=O)(=O)NC(=O)C)C.[Br-]

Isomeric SMILES

CCN1C(=[N+](C2=CC(=C(C=C21)Cl)Cl)CCCCS(=O)(=O)NC(=O)C)C.[Br-]

InChI

InChI=1S/C16H21Cl2N3O3S.BrH/c1-4-20-12(3)21(16-10-14(18)13(17)9-15(16)20)7-5-6-8-25(23,24)19-11(2)22;/h9-10H,4-8H2,1-3H3;1H