3-(2-azanyl-3-phenacyl-benzimidazol-3-ium-1-yl)propyl-dimethyl-azanium

Systemtic Name: 3-(2-azanyl-3-phenacyl-benzimidazol-3-ium-1-yl)propyl-dimethyl-azanium Openeye Name: 3-(2-amino-3-phenacyl-benzimidazol-3-ium-1-yl)propyl-dimethyl-ammonium CAS Name: 3-(2-amino-3-phenacyl-1-benzimidazol-3-iumyl)propyl-dimethylammonium IUPAC Name: 3-(2-amino-3-phenacylbenzimidazol-3-ium-1-yl)propyl-dimethylazanium Traditional Name: 3-(2-amino-3-phenacyl-benzimidazol-3-ium-1-yl)propyl-dimethyl-ammonium Formula: C20H26N4O+2 MolecularWeight: 338.44664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O/c1-22(2)13-8-14-23-17-11-6-7-12-18(17)24(20(23)21)15-19(25)16-9-4-3-5-10-16/h3-7,9-12,21H,8,13-15H2,1-2H3/p+2