2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino]butanoic acid

Systemtic Name: 2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino]butanoic acid Openeye Name: 2-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino]butanoic acid CAS Name: 2-[[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]amino]butanoic acid IUPAC Name: 2-[[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]amino]butanoic acid Traditional Name: 2-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino]butyric acid Formula: C11H16N4O5 MolecularWeight: 284.26854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N4O5/c1-4-8(11(17)18)12-9(16)5-14-7(3)10(15(19)20)6(2)13-14/h8H,4-5H2,1-3H3,(H,12,16)(H,17,18)