3-(4-ethanoyl-3,5-dimethyl-pyrazol-1-yl)butanoic acid

Systemtic Name: 3-(4-ethanoyl-3,5-dimethyl-pyrazol-1-yl)butanoic acid Openeye Name: 3-(4-acetyl-3,5-dimethyl-pyrazol-1-yl)butanoic acid CAS Name: 3-(4-acetyl-3,5-dimethyl-1-pyrazolyl)butanoic acid IUPAC Name: 3-(4-acetyl-3,5-dimethylpyrazol-1-yl)butanoic acid Traditional Name: 3-(4-acetyl-3,5-dimethyl-pyrazol-1-yl)butyric acid Formula: C11H16N2O3 MolecularWeight: 224.25634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)CC(=O)O)C)C(=O)C

Isomeric SMILES

CC1=C(C(=NN1C(C)CC(=O)O)C)C(=O)C

InChI

InChI=1S/C11H16N2O3/c1-6(5-10(15)16)13-8(3)11(9(4)14)7(2)12-13/h6H,5H2,1-4H3,(H,15,16)