1-[2-[2-(4-nitropyrazol-1-yl)ethylamino]-2-oxidanylidene-ethyl]pyrazole-4-carboxylate

Systemtic Name: 1-[2-[2-(4-nitropyrazol-1-yl)ethylamino]-2-oxidanylidene-ethyl]pyrazole-4-carboxylate Openeye Name: 1-[2-[2-(4-nitropyrazol-1-yl)ethylamino]-2-oxo-ethyl]pyrazole-4-carboxylate CAS Name: 1-[2-[2-(4-nitro-1-pyrazolyl)ethylamino]-2-oxoethyl]-4-pyrazolecarboxylate IUPAC Name: 1-[2-[2-(4-nitropyrazol-1-yl)ethylamino]-2-oxoethyl]pyrazole-4-carboxylate Traditional Name: 1-[2-keto-2-[2-(4-nitropyrazol-1-yl)ethylamino]ethyl]pyrazole-4-carboxylate Formula: C11H11N6O5- MolecularWeight: 307.24224

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NN1CC(=O)NCCN2C=C(C=N2)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=C(C=NN1CC(=O)NCCN2C=C(C=N2)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C11H12N6O5/c18-10(7-16-5-8(3-13-16)11(19)20)12-1-2-15-6-9(4-14-15)17(21)22/h3-6H,1-2,7H2,(H,12,18)(H,19,20)/p-1