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

Systemtic Name: [(Z)-[azanyl(phenyl)methylidene]amino] 2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propanoate Openeye Name: [(Z)-[amino(phenyl)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(phenyl)methylidene]amino] ester IUPAC Name: [(Z)-[amino(phenyl)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(phenyl)methylene]amino] ester Formula: C15H17N5O4 MolecularWeight: 331.32658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N5O4/c1-10(9-19-11(2)8-13(17-19)20(22)23)15(21)24-18-14(16)12-6-4-3-5-7-12/h3-8,10H,9H2,1-2H3,(H2,16,18)