1-[2-[2-(4-nitropyrazol-1-yl)ethylamino]-2-oxidanylidene-ethyl]pyrazole-3-carboxylate

Systemtic Name: 1-[2-[2-(4-nitropyrazol-1-yl)ethylamino]-2-oxidanylidene-ethyl]pyrazole-3-carboxylate Openeye Name: 1-[2-[2-(4-nitropyrazol-1-yl)ethylamino]-2-oxo-ethyl]pyrazole-3-carboxylate CAS Name: 1-[2-[2-(4-nitro-1-pyrazolyl)ethylamino]-2-oxoethyl]-3-pyrazolecarboxylate IUPAC Name: 1-[2-[2-(4-nitropyrazol-1-yl)ethylamino]-2-oxoethyl]pyrazole-3-carboxylate Traditional Name: 1-[2-keto-2-[2-(4-nitropyrazol-1-yl)ethylamino]ethyl]pyrazole-3-carboxylate Formula: C11H11N6O5- MolecularWeight: 307.24224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1C(=O)[O-])CC(=O)NCCN2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

C1=CN(N=C1C(=O)[O-])CC(=O)NCCN2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C11H12N6O5/c18-10(7-16-3-1-9(14-16)11(19)20)12-2-4-15-6-8(5-13-15)17(21)22/h1,3,5-6H,2,4,7H2,(H,12,18)(H,19,20)/p-1