1-ethyl-4-[2-(3-methoxy-4-nitro-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide

Systemtic Name: 1-ethyl-4-[2-(3-methoxy-4-nitro-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Openeye Name: 1-ethyl-4-[2-(3-methoxy-4-nitro-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide CAS Name: 1-ethyl-4-[[2-(3-methoxy-4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-3-pyrazolecarboxamide IUPAC Name: 1-ethyl-4-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Traditional Name: 1-ethyl-4-[2-(3-methoxy-4-nitro-pyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Formula: C13H17N7O5 MolecularWeight: 351.31798

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)N)NC(=O)C(C)N2C=C(C(=N2)OC)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)N)NC(=O)C(C)N2C=C(C(=N2)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H17N7O5/c1-4-18-5-8(10(16-18)11(14)21)15-12(22)7(2)19-6-9(20(23)24)13(17-19)25-3/h5-7H,4H2,1-3H3,(H2,14,21)(H,15,22)