[(Z)-[azanyl-(4-nitrophenyl)methylidene]amino] 3-(5-methyl-4-nitro-pyrazol-1-yl)propanoate

Systemtic Name: [(Z)-[azanyl-(4-nitrophenyl)methylidene]amino] 3-(5-methyl-4-nitro-pyrazol-1-yl)propanoate Openeye Name: [(Z)-[amino-(4-nitrophenyl)methylene]amino] 3-(5-methyl-4-nitro-pyrazol-1-yl)propanoate CAS Name: 3-(5-methyl-4-nitro-1-pyrazolyl)propanoic acid [(Z)-[amino-(4-nitrophenyl)methylidene]amino] ester IUPAC Name: [(Z)-[amino-(4-nitrophenyl)methylidene]amino] 3-(5-methyl-4-nitropyrazol-1-yl)propanoate Traditional Name: 3-(5-methyl-4-nitro-pyrazol-1-yl)propionic acid [(Z)-[amino-(4-nitrophenyl)methylene]amino] ester Formula: C14H14N6O6 MolecularWeight: 362.29756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1CCC(=O)ON=C(C2=CC=C(C=C2)[N+](=O)[O-])N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1CCC(=O)O/N=C(/C2=CC=C(C=C2)[N+](=O)[O-])\N)[N+](=O)[O-]

InChI

InChI=1S/C14H14N6O6/c1-9-12(20(24)25)8-16-18(9)7-6-13(21)26-17-14(15)10-2-4-11(5-3-10)19(22)23/h2-5,8H,6-7H2,1H3,(H2,15,17)