5-[(4-ethanoyl-3,5-dimethyl-pyrazol-1-yl)methyl]-1,2-oxazole-3-carboxylic acid

Systemtic Name: 5-[(4-ethanoyl-3,5-dimethyl-pyrazol-1-yl)methyl]-1,2-oxazole-3-carboxylic acid Openeye Name: 5-[(4-acetyl-3,5-dimethyl-pyrazol-1-yl)methyl]isoxazole-3-carboxylic acid CAS Name: 5-[(4-acetyl-3,5-dimethyl-1-pyrazolyl)methyl]-3-isoxazolecarboxylic acid IUPAC Name: 5-[(4-acetyl-3,5-dimethylpyrazol-1-yl)methyl]-1,2-oxazole-3-carboxylic acid Traditional Name: 5-[(4-acetyl-3,5-dimethyl-pyrazol-1-yl)methyl]isoxazole-3-carboxylic acid Formula: C12H13N3O4 MolecularWeight: 263.24932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=NO2)C(=O)O)C)C(=O)C

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=NO2)C(=O)O)C)C(=O)C

InChI

InChI=1S/C12H13N3O4/c1-6-11(8(3)16)7(2)15(13-6)5-9-4-10(12(17)18)14-19-9/h4H,5H2,1-3H3,(H,17,18)