[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl] 2-methyl-4-nitro-pyrazole-3-carboxylate

Systemtic Name: [2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl] 2-methyl-4-nitro-pyrazole-3-carboxylate Openeye Name: [2-(3,5-dimethylpyrazol-1-yl)-2-oxo-ethyl] 2-methyl-4-nitro-pyrazole-3-carboxylate CAS Name: 2-methyl-4-nitro-3-pyrazolecarboxylic acid [2-(3,5-dimethyl-1-pyrazolyl)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylpyrazol-1-yl)-2-oxoethyl] 2-methyl-4-nitropyrazole-3-carboxylate Traditional Name: 2-methyl-4-nitro-pyrazole-3-carboxylic acid [2-(3,5-dimethylpyrazol-1-yl)-2-keto-ethyl] ester Formula: C12H13N5O5 MolecularWeight: 307.26212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)COC(=O)C2=C(C=NN2C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C(=O)COC(=O)C2=C(C=NN2C)[N+](=O)[O-])C

InChI

InChI=1S/C12H13N5O5/c1-7-4-8(2)16(14-7)10(18)6-22-12(19)11-9(17(20)21)5-13-15(11)3/h4-5H,6H2,1-3H3