3-[4-[2-(4-nitropyrazol-1-yl)ethylcarbamoyl]pyrazol-1-yl]propanoate

Systemtic Name: 3-[4-[2-(4-nitropyrazol-1-yl)ethylcarbamoyl]pyrazol-1-yl]propanoate Openeye Name: 3-[4-[2-(4-nitropyrazol-1-yl)ethylcarbamoyl]pyrazol-1-yl]propanoate CAS Name: 3-[4-[[2-(4-nitro-1-pyrazolyl)ethylamino]-oxomethyl]-1-pyrazolyl]propanoate IUPAC Name: 3-[4-[2-(4-nitropyrazol-1-yl)ethylcarbamoyl]pyrazol-1-yl]propanoate Traditional Name: 3-[4-[2-(4-nitropyrazol-1-yl)ethylcarbamoyl]pyrazol-1-yl]propionate Formula: C12H13N6O5- MolecularWeight: 321.26882

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NN1CCC(=O)[O-])C(=O)NCCN2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=NN1CCC(=O)[O-])C(=O)NCCN2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N6O5/c19-11(20)1-3-16-7-9(5-14-16)12(21)13-2-4-17-8-10(6-15-17)18(22)23/h5-8H,1-4H2,(H,13,21)(H,19,20)/p-1