[(Z)-[azanyl-(4-nitrophenyl)methylidene]amino] 2-(4-nitropyrazol-1-yl)butanoate

Systemtic Name: [(Z)-[azanyl-(4-nitrophenyl)methylidene]amino] 2-(4-nitropyrazol-1-yl)butanoate Openeye Name: [(Z)-[amino-(4-nitrophenyl)methylene]amino] 2-(4-nitropyrazol-1-yl)butanoate CAS Name: 2-(4-nitro-1-pyrazolyl)butanoic acid [(Z)-[amino-(4-nitrophenyl)methylidene]amino] ester IUPAC Name: [(Z)-[amino-(4-nitrophenyl)methylidene]amino] 2-(4-nitropyrazol-1-yl)butanoate Traditional Name: 2-(4-nitropyrazol-1-yl)butyric acid [(Z)-[amino-(4-nitrophenyl)methylene]amino] ester Formula: C14H14N6O6 MolecularWeight: 362.29756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)ON=C(C1=CC=C(C=C1)[N+](=O)[O-])N)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)O/N=C(/C1=CC=C(C=C1)[N+](=O)[O-])\N)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H14N6O6/c1-2-12(18-8-11(7-16-18)20(24)25)14(21)26-17-13(15)9-3-5-10(6-4-9)19(22)23/h3-8,12H,2H2,1H3,(H2,15,17)