[(Z)-[azanyl-(4-tert-butylphenyl)methylidene]amino] 2,5-dimethyl-4-nitro-pyrazole-3-carboxylate

Systemtic Name: [(Z)-[azanyl-(4-tert-butylphenyl)methylidene]amino] 2,5-dimethyl-4-nitro-pyrazole-3-carboxylate Openeye Name: [(Z)-[amino-(4-tert-butylphenyl)methylene]amino] 2,5-dimethyl-4-nitro-pyrazole-3-carboxylate CAS Name: 2,5-dimethyl-4-nitro-3-pyrazolecarboxylic acid [(Z)-[amino-(4-tert-butylphenyl)methylidene]amino] ester IUPAC Name: [(Z)-[amino-(4-tert-butylphenyl)methylidene]amino] 2,5-dimethyl-4-nitropyrazole-3-carboxylate Traditional Name: 2,5-dimethyl-4-nitro-pyrazole-3-carboxylic acid [(Z)-[amino-(4-tert-butylphenyl)methylene]amino] ester Formula: C17H21N5O4 MolecularWeight: 359.37974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)ON=C(C2=CC=C(C=C2)C(C)(C)C)N)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)O/N=C(/C2=CC=C(C=C2)C(C)(C)C)\N)C

InChI

InChI=1S/C17H21N5O4/c1-10-13(22(24)25)14(21(5)19-10)16(23)26-20-15(18)11-6-8-12(9-7-11)17(2,3)4/h6-9H,1-5H3,(H2,18,20)