3-(4-ethylphenyl)-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-(4-ethylphenyl)-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 3-(4-ethylphenyl)-1-methyl-pyrazole-4-carboxylic acid CAS Name: 3-(4-ethylphenyl)-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(4-ethylphenyl)-1-methylpyrazole-4-carboxylic acid Traditional Name: 3-(4-ethylphenyl)-1-methyl-pyrazole-4-carboxylic acid Formula: C13H14N2O2 MolecularWeight: 230.26246

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(C=C2C(=O)O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(C=C2C(=O)O)C

InChI

InChI=1S/C13H14N2O2/c1-3-9-4-6-10(7-5-9)12-11(13(16)17)8-15(2)14-12/h4-8H,3H2,1-2H3,(H,16,17)