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

Systemtic Name: ethyl 1-methyl-5-[3-(5-methyl-3-nitro-pyrazol-1-yl)propanoylamino]pyrazole-4-carboxylate Openeye Name: ethyl 1-methyl-5-[3-(5-methyl-3-nitro-pyrazol-1-yl)propanoylamino]pyrazole-4-carboxylate CAS Name: 1-methyl-5-[[3-(5-methyl-3-nitro-1-pyrazolyl)-1-oxopropyl]amino]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-5-[3-(5-methyl-3-nitropyrazol-1-yl)propanoylamino]pyrazole-4-carboxylate Traditional Name: 1-methyl-5-[3-(5-methyl-3-nitro-pyrazol-1-yl)propanoylamino]pyrazole-4-carboxylic acid ethyl ester Formula: C14H18N6O5 MolecularWeight: 350.32992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C)NC(=O)CCN2C(=CC(=N2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C)NC(=O)CCN2C(=CC(=N2)[N+](=O)[O-])C

InChI

InChI=1S/C14H18N6O5/c1-4-25-14(22)10-8-15-18(3)13(10)16-12(21)5-6-19-9(2)7-11(17-19)20(23)24/h7-8H,4-6H2,1-3H3,(H,16,21)