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

Systemtic Name: propan-2-yl 1-ethyl-4-[2-(5-methyl-3-nitro-pyrazol-1-yl)butanoylamino]pyrazole-3-carboxylate Openeye Name: isopropyl 1-ethyl-4-[2-(5-methyl-3-nitro-pyrazol-1-yl)butanoylamino]pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[2-(5-methyl-3-nitro-1-pyrazolyl)-1-oxobutyl]amino]-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-ethyl-4-[2-(5-methyl-3-nitropyrazol-1-yl)butanoylamino]pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-[2-(5-methyl-3-nitro-pyrazol-1-yl)butanoylamino]pyrazole-3-carboxylic acid isopropyl ester Formula: C17H24N6O5 MolecularWeight: 392.40966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CN(N=C1C(=O)OC(C)C)CC)N2C(=CC(=N2)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NC1=CN(N=C1C(=O)OC(C)C)CC)N2C(=CC(=N2)[N+](=O)[O-])C

InChI

InChI=1S/C17H24N6O5/c1-6-13(22-11(5)8-14(19-22)23(26)27)16(24)18-12-9-21(7-2)20-15(12)17(25)28-10(3)4/h8-10,13H,6-7H2,1-5H3,(H,18,24)