N-(6-nitro-1-oxidanylidene-2-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)benzamide

Systemtic Name: N-(6-nitro-1-oxidanylidene-2-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)benzamide Openeye Name: N-(6-nitro-1-oxo-2-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)benzamide CAS Name: N-(6-nitro-1-oxo-2-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)benzamide IUPAC Name: N-(6-nitro-1-oxo-2-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)benzamide Traditional Name: N-(1-keto-6-nitro-2-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)benzamide Formula: C22H14N6O4 MolecularWeight: 426.38436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=NC3=C(C=CC=C3[N+](=O)[O-])N4C2=NN(C4=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=NC3=C(C=CC=C3[N+](=O)[O-])N4C2=NN(C4=O)C5=CC=CC=C5

InChI

InChI=1S/C22H14N6O4/c29-21(14-8-3-1-4-9-14)24-19-20-25-27(15-10-5-2-6-11-15)22(30)26(20)16-12-7-13-17(28(31)32)18(16)23-19/h1-13H,(H,23,24,29)