methyl 3-[[3-methyl-2-[(3-nitro-1H-pyrazol-5-yl)carbonylamino]butanoyl]amino]-1H-pyrazole-5-carboxylate

Systemtic Name: methyl 3-[[3-methyl-2-[(3-nitro-1H-pyrazol-5-yl)carbonylamino]butanoyl]amino]-1H-pyrazole-5-carboxylate Openeye Name: methyl 3-[[3-methyl-2-[(3-nitro-1H-pyrazole-5-carbonyl)amino]butanoyl]amino]-1H-pyrazole-5-carboxylate CAS Name: 3-[[3-methyl-2-[[(3-nitro-1H-pyrazol-5-yl)-oxomethyl]amino]-1-oxobutyl]amino]-1H-pyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[[3-methyl-2-[(3-nitro-1H-pyrazole-5-carbonyl)amino]butanoyl]amino]-1H-pyrazole-5-carboxylate Traditional Name: 3-[[3-methyl-2-[(3-nitro-1H-pyrazole-5-carbonyl)amino]butanoyl]amino]-1H-pyrazole-5-carboxylic acid methyl ester Formula: C14H17N7O6 MolecularWeight: 379.32808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=NNC(=C1)C(=O)OC)NC(=O)C2=CC(=NN2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C(=O)NC1=NNC(=C1)C(=O)OC)NC(=O)C2=CC(=NN2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N7O6/c1-6(2)11(16-12(22)7-5-10(20-17-7)21(25)26)13(23)15-9-4-8(18-19-9)14(24)27-3/h4-6,11H,1-3H3,(H,16,22)(H,17,20)(H2,15,18,19,23)