(E)-1-[2-[(2-tert-butyl-1,3-dioxan-5-yl)oxy]-2-oxidanylidene-ethoxy]-2-diazonio-ethenolate

Systemtic Name: (E)-1-[2-[(2-tert-butyl-1,3-dioxan-5-yl)oxy]-2-oxidanylidene-ethoxy]-2-diazonio-ethenolate Openeye Name: (E)-1-[2-[(2-tert-butyl-1,3-dioxan-5-yl)oxy]-2-oxo-ethoxy]-2-diazonio-ethenolate CAS Name: (E)-1-[2-[(2-tert-butyl-1,3-dioxan-5-yl)oxy]-2-oxoethoxy]-2-diazonioethenolate IUPAC Name: (E)-1-[2-[(2-tert-butyl-1,3-dioxan-5-yl)oxy]-2-oxoethoxy]-2-diazonioethenolate Traditional Name: (E)-1-[2-[(2-tert-butyl-1,3-dioxan-5-yl)oxy]-2-keto-ethoxy]-2-diazonio-ethenolate Formula: C12H18N2O6 MolecularWeight: 286.28112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1OCC(CO1)OC(=O)COC(=C[N+]#N)[O-]

Isomeric SMILES

CC(C)(C)C1OCC(CO1)OC(=O)CO/C(=C/[N+]#N)/[O-]

InChI

InChI=1S/C12H18N2O6/c1-12(2,3)11-18-5-8(6-19-11)20-10(16)7-17-9(15)4-14-13/h4,8,11H,5-7H2,1-3H3/b9-4+