2-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)-N-[(E)-(3-nitrophenyl)methylideneamino]ethanamide

Systemtic Name: 2-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)-N-[(E)-(3-nitrophenyl)methylideneamino]ethanamide Openeye Name: 2-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-N-[(E)-(3-nitrophenyl)methyleneamino]acetamide CAS Name: 2-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-N-[(E)-(3-nitrophenyl)methylideneamino]acetamide IUPAC Name: 2-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-N-[(E)-(3-nitrophenyl)methylideneamino]acetamide Traditional Name: 2-(3-keto-5-methyl-3-pyrazolin-4-yl)-N-[(E)-(3-nitrobenzylidene)amino]acetamide Formula: C13H13N5O4 MolecularWeight: 303.27342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)CC(=O)NN=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)NN1)CC(=O)N/N=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O4/c1-8-11(13(20)17-15-8)6-12(19)16-14-7-9-3-2-4-10(5-9)18(21)22/h2-5,7H,6H2,1H3,(H,16,19)(H2,15,17,20)/b14-7+