ethyl 1-methyl-5-[2-(3-methyl-4-nitro-pyrazol-1-yl)ethanoylamino]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-methyl-5-[2-(3-methyl-4-nitro-pyrazol-1-yl)ethanoylamino]pyrazole-4-carboxylate Openeye Name: ethyl 1-methyl-5-[[2-(3-methyl-4-nitro-pyrazol-1-yl)acetyl]amino]pyrazole-4-carboxylate CAS Name: 1-methyl-5-[[2-(3-methyl-4-nitro-1-pyrazolyl)-1-oxoethyl]amino]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-5-[[2-(3-methyl-4-nitropyrazol-1-yl)acetyl]amino]pyrazole-4-carboxylate Traditional Name: 1-methyl-5-[[2-(3-methyl-4-nitro-pyrazol-1-yl)acetyl]amino]pyrazole-4-carboxylic acid ethyl ester Formula: C13H16N6O5 MolecularWeight: 336.30334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C)NC(=O)CN2C=C(C(=N2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C)NC(=O)CN2C=C(C(=N2)C)[N+](=O)[O-]

InChI

InChI=1S/C13H16N6O5/c1-4-24-13(21)9-5-14-17(3)12(9)15-11(20)7-18-6-10(19(22)23)8(2)16-18/h5-6H,4,7H2,1-3H3,(H,15,20)