(3E)-N-(3-nitrophenyl)-3-(2-pyridin-1-ium-1-ylethanoylhydrazinylidene)butanamide

Systemtic Name: (3E)-N-(3-nitrophenyl)-3-(2-pyridin-1-ium-1-ylethanoylhydrazinylidene)butanamide Openeye Name: (3E)-N-(3-nitrophenyl)-3-[(2-pyridin-1-ium-1-ylacetyl)hydrazono]butanamide CAS Name: (3E)-N-(3-nitrophenyl)-3-[[1-oxo-2-(1-pyridin-1-iumyl)ethyl]hydrazinylidene]butanamide IUPAC Name: (3E)-N-(3-nitrophenyl)-3-[(2-pyridin-1-ium-1-ylacetyl)hydrazinylidene]butanamide Traditional Name: (3E)-N-(3-nitrophenyl)-3-[(2-pyridin-1-ium-1-ylacetyl)hydrazono]butyramide Formula: C17H18N5O4+ MolecularWeight: 356.35592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N5O4/c1-13(19-20-17(24)12-21-8-3-2-4-9-21)10-16(23)18-14-6-5-7-15(11-14)22(25)26/h2-9,11H,10,12H2,1H3,(H-,18,20,23,24)/p+1/b19-13+