sodium 1-oxidanylidene-4-propan-2-yl-2H-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxylate

Systemtic Name: sodium 1-oxidanylidene-4-propan-2-yl-2H-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxylate Openeye Name: sodium 4-isopropyl-1-oxo-2H-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxylate CAS Name: sodium 1-oxo-4-propan-2-yl-2H-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxylate IUPAC Name: sodium 1-oxo-4-propan-2-yl-2H-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxylate Traditional Name: sodium 4-isopropyl-1-keto-2H-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxylate Formula: C13H11N4NaO3 MolecularWeight: 294.24121

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C=C(C=C2)C(=O)[O-])N3C1=NNC3=O.[Na+]

Isomeric SMILES

CC(C)C1=NC2=C(C=C(C=C2)C(=O)[O-])N3C1=NNC3=O.[Na+]

InChI

InChI=1S/C13H12N4O3.Na/c1-6(2)10-11-15-16-13(20)17(11)9-5-7(12(18)19)3-4-8(9)14-10;/h3-6H,1-2H3,(H,16,20)(H,18,19);/q;+1/p-1