propan-2-yl 1-ethyl-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 1-ethyl-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxylate Openeye Name: isopropyl 1-ethyl-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[3-(3-nitro-1-pyrazolyl)-1-oxopropyl]amino]-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-ethyl-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxylic acid isopropyl ester Formula: C15H20N6O5 MolecularWeight: 364.3565

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)CCN2C=CC(=N2)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)CCN2C=CC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C15H20N6O5/c1-4-19-9-11(14(18-19)15(23)26-10(2)3)16-13(22)6-8-20-7-5-12(17-20)21(24)25/h5,7,9-10H,4,6,8H2,1-3H3,(H,16,22)