sodium [6-nitro-3-oxidanylidene-7-(4-oxidanylidenepyridin-1-yl)-4H-quinoxalin-1-id-2-ylidene]cyanamide

Systemtic Name: sodium [6-nitro-3-oxidanylidene-7-(4-oxidanylidenepyridin-1-yl)-4H-quinoxalin-1-id-2-ylidene]cyanamide Openeye Name: sodium [6-nitro-3-oxo-7-(4-oxo-1-pyridyl)-4H-quinoxalin-1-id-2-ylidene]cyanamide CAS Name: sodium [6-nitro-3-oxo-7-(4-oxo-1-pyridinyl)-4H-quinoxalin-1-id-2-ylidene]cyanamide IUPAC Name: sodium [6-nitro-3-oxo-7-(4-oxopyridin-1-yl)-4H-quinoxalin-1-id-2-ylidene]cyanamide Traditional Name: sodium [3-keto-7-(4-keto-1-pyridyl)-6-nitro-4H-quinoxalin-1-id-2-ylidene]cyanamide Formula: C14H7N6NaO4 MolecularWeight: 346.23295

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=CC1=O)C2=C(C=C3C(=C2)[N-]C(=NC#N)C(=O)N3)[N+](=O)[O-].[Na+]

Isomeric SMILES

C1=CN(C=CC1=O)C2=C(C=C3C(=C2)[N-]C(=NC#N)C(=O)N3)[N+](=O)[O-].[Na+]

InChI

InChI=1S/C14H8N6O4.Na/c15-7-16-13-14(22)18-10-6-12(20(23)24)11(5-9(10)17-13)19-3-1-8(21)2-4-19;/h1-6H,(H2,16,17,18,22);/q;+1/p-1