3-methyl-5-(2-methylbutan-2-yloxy)-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-methyl-5-(2-methylbutan-2-yloxy)-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 5-(1,1-dimethylpropoxy)-3-methyl-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 3-methyl-5-(2-methylbutan-2-yloxy)-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 3-methyl-5-(2-methylbutan-2-yloxy)-1-phenylpyrazole-4-carboxylic acid Traditional Name: 5-tert-amyloxy-3-methyl-1-phenyl-pyrazole-4-carboxylic acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)OC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)O

Isomeric SMILES

CCC(C)(C)OC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)O

InChI

InChI=1S/C16H20N2O3/c1-5-16(3,4)21-14-13(15(19)20)11(2)17-18(14)12-9-7-6-8-10-12/h6-10H,5H2,1-4H3,(H,19,20)