sodium 5-cyano-6-(cyanoamino)-4-(4-nitrophenyl)-3,4-dihydropyridin-2-olate

Systemtic Name: sodium 5-cyano-6-(cyanoamino)-4-(4-nitrophenyl)-3,4-dihydropyridin-2-olate Openeye Name: sodium 5-cyano-6-(cyanoamino)-4-(4-nitrophenyl)-3,4-dihydropyridin-2-olate CAS Name: sodium 5-cyano-6-(cyanoamino)-4-(4-nitrophenyl)-3,4-dihydropyridin-2-olate IUPAC Name: sodium 5-cyano-6-(cyanoamino)-4-(4-nitrophenyl)-3,4-dihydropyridin-2-olate Traditional Name: sodium 5-cyano-6-(cyanoamino)-4-(4-nitrophenyl)-3,4-dihydropyridin-2-olate Formula: C13H8N5NaO3 MolecularWeight: 305.22409

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=C(N=C1[O-])NC#N)C#N)C2=CC=C(C=C2)[N+](=O)[O-].[Na+]

Isomeric SMILES

C1C(C(=C(N=C1[O-])NC#N)C#N)C2=CC=C(C=C2)[N+](=O)[O-].[Na+]

InChI

InChI=1S/C13H9N5O3.Na/c14-6-11-10(5-12(19)17-13(11)16-7-15)8-1-3-9(4-2-8)18(20)21;/h1-4,10,16H,5H2,(H,17,19);/q;+1/p-1