(E)-6-azido-2-diazonio-3-oxidanylidene-4-(2-oxidanylideneazetidin-1-yl)-1-prop-2-enoxy-hept-1-en-1-olate

Systemtic Name: (E)-6-azido-2-diazonio-3-oxidanylidene-4-(2-oxidanylideneazetidin-1-yl)-1-prop-2-enoxy-hept-1-en-1-olate Openeye Name: (E)-1-allyloxy-6-azido-2-diazonio-3-oxo-4-(2-oxoazetidin-1-yl)hept-1-en-1-olate CAS Name: (E)-6-azido-2-diazonio-3-oxo-4-(2-oxo-1-azetidinyl)-1-prop-2-enoxy-1-hepten-1-olate IUPAC Name: (E)-6-azido-2-diazonio-3-oxo-4-(2-oxoazetidin-1-yl)-1-prop-2-enoxyhept-1-en-1-olate Traditional Name: (E)-1-allyloxy-6-azido-2-diazonio-3-keto-4-(2-ketoazetidin-1-yl)hept-1-en-1-olate Formula: C13H16N6O4 MolecularWeight: 320.30394

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C(=O)C(=C([O-])OCC=C)[N+]#N)N1CCC1=O)N=[N+]=[N-]

Isomeric SMILES

CC(CC(C(=O)/C(=C(/[O-])\OCC=C)/[N+]#N)N1CCC1=O)N=[N+]=[N-]

InChI

InChI=1S/C13H16N6O4/c1-3-6-23-13(22)11(16-14)12(21)9(7-8(2)17-18-15)19-5-4-10(19)20/h3,8-9H,1,4-7H2,2H3