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

Systemtic Name: sodium 4-(4-bromophenyl)-5-cyano-6-(cyanoamino)-3,4-dihydropyridin-2-olate Openeye Name: sodium 4-(4-bromophenyl)-5-cyano-6-(cyanoamino)-3,4-dihydropyridin-2-olate CAS Name: sodium 4-(4-bromophenyl)-5-cyano-6-(cyanoamino)-3,4-dihydropyridin-2-olate IUPAC Name: sodium 4-(4-bromophenyl)-5-cyano-6-(cyanoamino)-3,4-dihydropyridin-2-olate Traditional Name: sodium 4-(4-bromophenyl)-5-cyano-6-(cyanoamino)-3,4-dihydropyridin-2-olate Formula: C13H8BrN4NaO MolecularWeight: 339.12259

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9BrN4O.Na/c14-9-3-1-8(2-4-9)10-5-12(19)18-13(17-7-16)11(10)6-15;/h1-4,10,17H,5H2,(H,18,19);/q;+1/p-1