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

Systemtic Name: 2-[3-[2-(4-nitropyrazol-1-yl)ethylcarbamoyl]pyrazol-1-yl]ethanoic acid Openeye Name: 2-[3-[2-(4-nitropyrazol-1-yl)ethylcarbamoyl]pyrazol-1-yl]acetic acid CAS Name: 2-[3-[[2-(4-nitro-1-pyrazolyl)ethylamino]-oxomethyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[3-[2-(4-nitropyrazol-1-yl)ethylcarbamoyl]pyrazol-1-yl]acetic acid Traditional Name: 2-[3-[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=CN(N=C1C(=O)NCCN2C=C(C=N2)[N+](=O)[O-])CC(=O)O

Isomeric SMILES

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

InChI

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