[(Z)-[azanyl-(4-nitrophenyl)methylidene]amino] 2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propanoate

Systemtic Name: [(Z)-[azanyl-(4-nitrophenyl)methylidene]amino] 2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propanoate Openeye Name: [(Z)-[amino-(4-nitrophenyl)methylene]amino] 2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propanoate CAS Name: 2-methyl-3-(5-methyl-3-nitro-1-pyrazolyl)propanoic acid [(Z)-[amino-(4-nitrophenyl)methylidene]amino] ester IUPAC Name: [(Z)-[amino-(4-nitrophenyl)methylidene]amino] 2-methyl-3-(5-methyl-3-nitropyrazol-1-yl)propanoate Traditional Name: 2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propionic acid [(Z)-[amino-(4-nitrophenyl)methylene]amino] ester Formula: C15H16N6O6 MolecularWeight: 376.32414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(C)C(=O)ON=C(C2=CC=C(C=C2)[N+](=O)[O-])N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC(C)C(=O)O/N=C(/C2=CC=C(C=C2)[N+](=O)[O-])\N)[N+](=O)[O-]

InChI

InChI=1S/C15H16N6O6/c1-9(8-19-10(2)7-13(17-19)21(25)26)15(22)27-18-14(16)11-3-5-12(6-4-11)20(23)24/h3-7,9H,8H2,1-2H3,(H2,16,18)