(5-phenyl-1,2-oxazol-3-yl)methyl 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoate

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoate Openeye Name: (5-phenylisoxazol-3-yl)methyl 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetate CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)acetic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl 2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetate Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetic acid (5-phenylisoxazol-3-yl)methyl ester Formula: C17H16N4O5 MolecularWeight: 356.33274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)OCC2=NOC(=C2)C3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)OCC2=NOC(=C2)C3=CC=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O5/c1-11-17(21(23)24)12(2)20(18-11)9-16(22)25-10-14-8-15(26-19-14)13-6-4-3-5-7-13/h3-8H,9-10H2,1-2H3