4-[3-(3-methoxy-4-nitro-pyrazol-1-yl)propanoylamino]-N,1-dimethyl-pyrazole-3-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NN(C=C1NC(=O)CCN2C=C(C(=N2)OC)[N+](=O)[O-])C

Isomeric SMILES

CNC(=O)C1=NN(C=C1NC(=O)CCN2C=C(C(=N2)OC)[N+](=O)[O-])C

InChI

InChI=1S/C13H17N7O5/c1-14-12(22)11-8(6-18(2)16-11)15-10(21)4-5-19-7-9(20(23)24)13(17-19)25-3/h6-7H,4-5H2,1-3H3,(H,14,22)(H,15,21)