2-[4-[2-(4-nitropyrazol-1-yl)ethylcarbamoyl]pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-[2-(4-nitropyrazol-1-yl)ethylcarbamoyl]pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-[2-(4-nitropyrazol-1-yl)ethylcarbamoyl]pyrazol-1-yl]acetic acid CAS Name: 2-[4-[[2-(4-nitro-1-pyrazolyl)ethylamino]-oxomethyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-[2-(4-nitropyrazol-1-yl)ethylcarbamoyl]pyrazol-1-yl]acetic acid Traditional Name: 2-[4-[2-(4-nitropyrazol-1-yl)ethylcarbamoyl]pyrazol-1-yl]acetic acid Formula: C11H12N6O5 MolecularWeight: 308.25018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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