N-oxidanyl-2-[[(6E)-4-oxidanylidene-6-(2-pyridin-1-ium-1-ylethanoylhydrazinylidene)octanoyl]amino]benzeneamine oxide hydrochloride

Systemtic Name: N-oxidanyl-2-[[(6E)-4-oxidanylidene-6-(2-pyridin-1-ium-1-ylethanoylhydrazinylidene)octanoyl]amino]benzeneamine oxide hydrochloride Openeye Name: N-hydroxy-2-[[(6E)-4-oxo-6-[(2-pyridin-1-ium-1-ylacetyl)hydrazono]octanoyl]amino]benzeneamine oxide hydrochloride CAS Name: 2-[[(6E)-1,4-dioxo-6-[[1-oxo-2-(1-pyridin-1-iumyl)ethyl]hydrazinylidene]octyl]amino]-N-hydroxybenzeneamine oxide hydrochloride IUPAC Name: N-hydroxy-2-[[(6E)-4-oxo-6-[(2-pyridin-1-ium-1-ylacetyl)hydrazinylidene]octanoyl]amino]benzeneamine oxide hydrochloride Traditional Name: N-hydroxy-2-[[(6E)-4-keto-6-[(2-pyridin-1-ium-1-ylacetyl)hydrazono]octanoyl]amino]benzeneamine oxide hydrochloride Formula: C21H27ClN5O5+ MolecularWeight: 464.92258

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=O)C[N+]1=CC=CC=C1)CC(=O)CCC(=O)NC2=CC=CC=C2[NH+](O)[O-].Cl

Isomeric SMILES

CC/C(=N\NC(=O)C[N+]1=CC=CC=C1)/CC(=O)CCC(=O)NC2=CC=CC=C2[NH+](O)[O-].Cl

InChI

InChI=1S/C21H25N5O5.ClH/c1-2-16(23-24-21(29)15-25-12-6-3-7-13-25)14-17(27)10-11-20(28)22-18-8-4-5-9-19(18)26(30)31;/h3-9,12-13,26,30H,2,10-11,14-15H2,1H3,(H-,22,24,28,29);1H/p+1/b23-16+;