(E)-1-(cyanomethylamino)-1-oxidanyl-3-oxidanylidene-but-1-ene-2-diazonium

Systemtic Name: (E)-1-(cyanomethylamino)-1-oxidanyl-3-oxidanylidene-but-1-ene-2-diazonium Openeye Name: (E)-1-(cyanomethylamino)-1-hydroxy-3-oxo-but-1-ene-2-diazonium CAS Name: (E)-1-(cyanomethylamino)-1-hydroxy-3-oxo-1-butene-2-diazonium IUPAC Name: (E)-1-(cyanomethylamino)-1-hydroxy-3-oxobut-1-ene-2-diazonium Traditional Name: (E)-1-(cyanomethylamino)-1-hydroxy-3-keto-but-1-ene-2-diazonium Formula: C6H7N4O2+ MolecularWeight: 167.14538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(NCC#N)O)[N+]#N

Isomeric SMILES

CC(=O)/C(=C(/NCC#N)\O)/[N+]#N

InChI

InChI=1S/C6H6N4O2/c1-4(11)5(10-8)6(12)9-3-2-7/h3H2,1H3,(H-,9,11,12)/p+1