(E)-4-[3-(1-azidoethyl)-4-oxidanylidene-azetidin-2-yl]-2-diazonio-3-oxidanylidene-1-prop-2-enoxy-pent-1-en-1-olate

Systemtic Name: (E)-4-[3-(1-azidoethyl)-4-oxidanylidene-azetidin-2-yl]-2-diazonio-3-oxidanylidene-1-prop-2-enoxy-pent-1-en-1-olate Openeye Name: (E)-1-allyloxy-4-[3-(1-azidoethyl)-4-oxo-azetidin-2-yl]-2-diazonio-3-oxo-pent-1-en-1-olate CAS Name: (E)-4-[3-(1-azidoethyl)-4-oxo-2-azetidinyl]-2-diazonio-3-oxo-1-prop-2-enoxy-1-penten-1-olate IUPAC Name: (E)-4-[3-(1-azidoethyl)-4-oxoazetidin-2-yl]-2-diazonio-3-oxo-1-prop-2-enoxypent-1-en-1-olate Traditional Name: (E)-1-allyloxy-4-[3-(1-azidoethyl)-4-keto-azetidin-2-yl]-2-diazonio-3-keto-pent-1-en-1-olate Formula: C13H16N6O4 MolecularWeight: 320.30394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(NC1=O)C(C)C(=O)C(=C([O-])OCC=C)[N+]#N)N=[N+]=[N-]

Isomeric SMILES

CC(C1C(NC1=O)C(C)C(=O)/C(=C(/[O-])\OCC=C)/[N+]#N)N=[N+]=[N-]

InChI

InChI=1S/C13H16N6O4/c1-4-5-23-13(22)10(17-14)11(20)6(2)9-8(12(21)16-9)7(3)18-19-15/h4,6-9H,1,5H2,2-3H3,(H-,16,20,21,22)