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

Systemtic Name: 3,3-dimethyl-2-[2-(4-nitropyrazol-1-yl)ethanoylamino]butanoic acid Openeye Name: 3,3-dimethyl-2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]butanoic acid CAS Name: 3,3-dimethyl-2-[[2-(4-nitro-1-pyrazolyl)-1-oxoethyl]amino]butanoic acid IUPAC Name: 3,3-dimethyl-2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]butanoic acid Traditional Name: 3,3-dimethyl-2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]butyric acid Formula: C11H16N4O5 MolecularWeight: 284.26854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N4O5/c1-11(2,3)9(10(17)18)13-8(16)6-14-5-7(4-12-14)15(19)20/h4-5,9H,6H2,1-3H3,(H,13,16)(H,17,18)