azanium (1Z,3E)-1-azanyl-2-cyano-5-(dicyanomethylidene)hepta-1,3-dien-1-olate

Systemtic Name: azanium (1Z,3E)-1-azanyl-2-cyano-5-(dicyanomethylidene)hepta-1,3-dien-1-olate Openeye Name: ammonium (1Z,3E)-1-amino-2-cyano-5-(dicyanomethylene)hepta-1,3-dien-1-olate CAS Name: ammonium (1Z,3E)-1-amino-2-cyano-5-(dicyanomethylidene)-1-hepta-1,3-dienolate IUPAC Name: azanium (1Z,3E)-1-amino-2-cyano-5-(dicyanomethylidene)hepta-1,3-dien-1-olate Traditional Name: ammonium (1Z,3E)-1-amino-2,6,6-tricyano-5-ethyl-hexa-1,3,5-trien-1-olate Formula: C11H13N5O MolecularWeight: 231.25382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C#N)C#N)C=CC(=C(N)[O-])C#N.[NH4+]

Isomeric SMILES

CCC(=C(C#N)C#N)/C=C/C(=C(\N)/[O-])/C#N.[NH4+]

InChI

InChI=1S/C11H10N4O.H3N/c1-2-8(10(6-13)7-14)3-4-9(5-12)11(15)16;/h3-4,16H,2,15H2,1H3;1H3/b4-3+,11-9-;