2-(2-azanyl-3-butyl-benzimidazol-1-ium-1-yl)-1-(5-nitrofuran-2-yl)ethanone

Systemtic Name: 2-(2-azanyl-3-butyl-benzimidazol-1-ium-1-yl)-1-(5-nitrofuran-2-yl)ethanone Openeye Name: 2-(2-amino-3-butyl-benzimidazol-1-ium-1-yl)-1-(5-nitro-2-furyl)ethanone CAS Name: 2-(2-amino-3-butyl-1-benzimidazol-1-iumyl)-1-(5-nitro-2-furanyl)ethanone IUPAC Name: 2-(2-amino-3-butylbenzimidazol-1-ium-1-yl)-1-(5-nitrofuran-2-yl)ethanone Traditional Name: 2-(2-amino-3-butyl-benzimidazol-1-ium-1-yl)-1-(5-nitro-2-furyl)ethanone Formula: C17H19N4O4+ MolecularWeight: 343.35716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O4/c1-2-3-10-19-12-6-4-5-7-13(12)20(17(19)18)11-14(22)15-8-9-16(25-15)21(23)24/h4-9,18H,2-3,10-11H2,1H3/p+1