(E)-2-cyano-3-(diazonioamino)-1-methoxy-3-octylimino-prop-1-en-1-olate

Systemtic Name: (E)-2-cyano-3-(diazonioamino)-1-methoxy-3-octylimino-prop-1-en-1-olate Openeye Name: (E)-2-cyano-3-(diazonioamino)-1-methoxy-3-octylimino-prop-1-en-1-olate CAS Name: (E)-2-cyano-3-(diazonioamino)-1-methoxy-3-octylimino-1-propen-1-olate IUPAC Name: (E)-2-cyano-3-(diazonioamino)-1-methoxy-3-octyliminoprop-1-en-1-olate Traditional Name: (E)-2-cyano-3-(diazonioamino)-1-methoxy-3-octylimino-prop-1-en-1-olate Formula: C13H21N5O2 MolecularWeight: 279.33814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN=C(C(=C([O-])OC)C#N)N[N+]#N

Isomeric SMILES

CCCCCCCCN=C(/C(=C(\[O-])/OC)/C#N)N[N+]#N

InChI

InChI=1S/C13H21N5O2/c1-3-4-5-6-7-8-9-16-12(17-18-15)11(10-14)13(19)20-2/h3-9H2,1-2H3,(H-,16,17,19)