(E)-(5-diazonioimidazol-4-ylidene)-octoxy-methanolate

Systemtic Name: (E)-(5-diazonioimidazol-4-ylidene)-octoxy-methanolate Openeye Name: (E)-(5-diazonioimidazol-4-ylidene)-octoxy-methanolate CAS Name: (E)-(5-diazonio-4-imidazolylidene)-octoxymethanolate IUPAC Name: (E)-(5-diazonioimidazol-4-ylidene)-octoxymethanolate Traditional Name: (E)-(5-diazonioimidazol-4-ylidene)-octoxy-methanolate Formula: C12H18N4O2 MolecularWeight: 250.29692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=C1C(=NC=N1)[N+]#N)[O-]

Isomeric SMILES

CCCCCCCCO/C(=C/1\C(=NC=N1)[N+]#N)/[O-]

InChI

InChI=1S/C12H18N4O2/c1-2-3-4-5-6-7-8-18-12(17)10-11(16-13)15-9-14-10/h9H,2-8H2,1H3