3-[2-azanyl-3-[2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl]benzimidazol-3-ium-1-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[2-azanyl-3-[2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl]benzimidazol-3-ium-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[2-amino-3-[2-(3,4-dichlorophenyl)-2-oxo-ethyl]benzimidazol-3-ium-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[2-amino-3-[2-(3,4-dichlorophenyl)-2-oxoethyl]-1-benzimidazol-3-iumyl]propyl-dimethylammonium IUPAC Name: 3-[2-amino-3-[2-(3,4-dichlorophenyl)-2-oxoethyl]benzimidazol-3-ium-1-yl]propyl-dimethylazanium Traditional Name: 3-[2-amino-3-[2-(3,4-dichlorophenyl)-2-keto-ethyl]benzimidazol-3-ium-1-yl]propyl-dimethyl-ammonium Formula: C20H24Cl2N4O+2 MolecularWeight: 407.33676

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C[NH+](C)CCCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H22Cl2N4O/c1-24(2)10-5-11-25-17-6-3-4-7-18(17)26(20(25)23)13-19(27)14-8-9-15(21)16(22)12-14/h3-4,6-9,12,23H,5,10-11,13H2,1-2H3/p+2