4-[2-(4-nitropyrazol-1-yl)ethanoylamino]butanoic acid

Systemtic Name: 4-[2-(4-nitropyrazol-1-yl)ethanoylamino]butanoic acid Openeye Name: 4-[[2-(4-nitropyrazol-1-yl)acetyl]amino]butanoic acid CAS Name: 4-[[2-(4-nitro-1-pyrazolyl)-1-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-(4-nitropyrazol-1-yl)acetyl]amino]butanoic acid Traditional Name: 4-[[2-(4-nitropyrazol-1-yl)acetyl]amino]butyric acid Formula: C9H12N4O5 MolecularWeight: 256.21538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12N4O5/c14-8(10-3-1-2-9(15)16)6-12-5-7(4-11-12)13(17)18/h4-5H,1-3,6H2,(H,10,14)(H,15,16)