2-(3-butylbenzimidazol-1-ium-1-yl)-1-(3-nitrophenyl)ethanone

Systemtic Name: 2-(3-butylbenzimidazol-1-ium-1-yl)-1-(3-nitrophenyl)ethanone Openeye Name: 2-(3-butylbenzimidazol-1-ium-1-yl)-1-(3-nitrophenyl)ethanone CAS Name: 2-(3-butyl-1-benzimidazol-1-iumyl)-1-(3-nitrophenyl)ethanone IUPAC Name: 2-(3-butylbenzimidazol-1-ium-1-yl)-1-(3-nitrophenyl)ethanone Traditional Name: 2-(3-butylbenzimidazol-1-ium-1-yl)-1-(3-nitrophenyl)ethanone Formula: C19H20N3O3+ MolecularWeight: 338.3804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=[N+](C2=CC=CC=C21)CC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C=[N+](C2=CC=CC=C21)CC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N3O3/c1-2-3-11-20-14-21(18-10-5-4-9-17(18)20)13-19(23)15-7-6-8-16(12-15)22(24)25/h4-10,12,14H,2-3,11,13H2,1H3/q+1