2-[2-(4-nitropyrazol-1-yl)ethanoylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[2-(4-nitropyrazol-1-yl)ethanoylamino]-3-oxidanyl-butanoic acid Openeye Name: 3-hydroxy-2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]butanoic acid CAS Name: 3-hydroxy-2-[[2-(4-nitro-1-pyrazolyl)-1-oxoethyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]butanoic acid Traditional Name: 3-hydroxy-2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]butyric acid Formula: C9H12N4O6 MolecularWeight: 272.21478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)CN1C=C(C=N1)[N+](=O)[O-])O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)CN1C=C(C=N1)[N+](=O)[O-])O

InChI

InChI=1S/C9H12N4O6/c1-5(14)8(9(16)17)11-7(15)4-12-3-6(2-10-12)13(18)19/h2-3,5,8,14H,4H2,1H3,(H,11,15)(H,16,17)