4-(2-methylpropoxy)-1-phenyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-(2-methylpropoxy)-1-phenyl-pyrazole-3-carboxylic acid Openeye Name: 4-isobutoxy-1-phenyl-pyrazole-3-carboxylic acid CAS Name: 4-(2-methylpropoxy)-1-phenyl-3-pyrazolecarboxylic acid IUPAC Name: 4-(2-methylpropoxy)-1-phenylpyrazole-3-carboxylic acid Traditional Name: 4-isobutoxy-1-phenyl-pyrazole-3-carboxylic acid Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CN(N=C1C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC(C)COC1=CN(N=C1C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C14H16N2O3/c1-10(2)9-19-12-8-16(15-13(12)14(17)18)11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3,(H,17,18)