ethyl 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-5-methyl-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-5-methyl-1,2-oxazole-3-carboxylate Openeye Name: ethyl 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-5-methyl-isoxazole-3-carboxylate CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-5-methyl-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-5-methyl-1,2-oxazole-3-carboxylate Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-5-methyl-isoxazole-3-carboxylic acid ethyl ester Formula: C13H16N4O5 MolecularWeight: 308.28994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1CN2C(=C(C(=N2)C)[N+](=O)[O-])C)C

Isomeric SMILES

CCOC(=O)C1=NOC(=C1CN2C(=C(C(=N2)C)[N+](=O)[O-])C)C

InChI

InChI=1S/C13H16N4O5/c1-5-21-13(18)11-10(9(4)22-15-11)6-16-8(3)12(17(19)20)7(2)14-16/h5-6H2,1-4H3