(E)-2-diazonio-1,4-dimethoxy-3-oxidanylidene-4-(4-oxidanylideneazetidin-2-yl)but-1-en-1-olate

Systemtic Name: (E)-2-diazonio-1,4-dimethoxy-3-oxidanylidene-4-(4-oxidanylideneazetidin-2-yl)but-1-en-1-olate Openeye Name: (E)-2-diazonio-1,4-dimethoxy-3-oxo-4-(4-oxoazetidin-2-yl)but-1-en-1-olate CAS Name: (E)-2-diazonio-1,4-dimethoxy-3-oxo-4-(4-oxo-2-azetidinyl)-1-buten-1-olate IUPAC Name: (E)-2-diazonio-1,4-dimethoxy-3-oxo-4-(4-oxoazetidin-2-yl)but-1-en-1-olate Traditional Name: (E)-2-diazonio-3-keto-4-(4-ketoazetidin-2-yl)-1,4-dimethoxy-but-1-en-1-olate Formula: C9H11N3O5 MolecularWeight: 241.20074

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1CC(=O)N1)C(=O)C(=C([O-])OC)[N+]#N

Isomeric SMILES

COC(C1CC(=O)N1)C(=O)/C(=C(/[O-])\OC)/[N+]#N

InChI

InChI=1S/C9H11N3O5/c1-16-8(4-3-5(13)11-4)7(14)6(12-10)9(15)17-2/h4,8H,3H2,1-2H3,(H-,11,13,14,15)