N-[(E)-(2-nitrophenyl)methylideneamino]-2-(5-oxidanylidene-1,2-dihydropyrazol-3-yl)ethanamide

Systemtic Name: N-[(E)-(2-nitrophenyl)methylideneamino]-2-(5-oxidanylidene-1,2-dihydropyrazol-3-yl)ethanamide Openeye Name: N-[(E)-(2-nitrophenyl)methyleneamino]-2-(5-oxo-1,2-dihydropyrazol-3-yl)acetamide CAS Name: N-[(E)-(2-nitrophenyl)methylideneamino]-2-(5-oxo-1,2-dihydropyrazol-3-yl)acetamide IUPAC Name: N-[(E)-(2-nitrophenyl)methylideneamino]-2-(5-oxo-1,2-dihydropyrazol-3-yl)acetamide Traditional Name: 2-(5-keto-3-pyrazolin-3-yl)-N-[(E)-(2-nitrobenzylidene)amino]acetamide Formula: C12H11N5O4 MolecularWeight: 289.24684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=NNC(=O)CC2=CC(=O)NN2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)/C=N/NC(=O)CC2=CC(=O)NN2)[N+](=O)[O-]

InChI

InChI=1S/C12H11N5O4/c18-11(5-9-6-12(19)16-14-9)15-13-7-8-3-1-2-4-10(8)17(20)21/h1-4,6-7H,5H2,(H,15,18)(H2,14,16,19)/b13-7+