1-(1-butyl-2-methyl-1-oxidanyl-benzimidazol-1-ium-5-yl)ethanone

Systemtic Name: 1-(1-butyl-2-methyl-1-oxidanyl-benzimidazol-1-ium-5-yl)ethanone Openeye Name: 1-(1-butyl-1-hydroxy-2-methyl-benzimidazol-1-ium-5-yl)ethanone CAS Name: 1-(1-butyl-1-hydroxy-2-methyl-5-benzimidazol-1-iumyl)ethanone IUPAC Name: 1-(1-butyl-1-hydroxy-2-methylbenzimidazol-1-ium-5-yl)ethanone Traditional Name: 1-(1-butyl-1-hydroxy-2-methyl-benzimidazol-1-ium-5-yl)ethanone Formula: C14H19N2O2+ MolecularWeight: 247.31286

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(C(=NC2=C1C=CC(=C2)C(=O)C)C)O

Isomeric SMILES

CCCC[N+]1(C(=NC2=C1C=CC(=C2)C(=O)C)C)O

InChI

InChI=1S/C14H19N2O2/c1-4-5-8-16(18)11(3)15-13-9-12(10(2)17)6-7-14(13)16/h6-7,9,18H,4-5,8H2,1-3H3/q+1