1-(2,5-dimethylphenyl)-5-ethyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(2,5-dimethylphenyl)-5-ethyl-pyrazole-4-carboxylic acid Openeye Name: 1-(2,5-dimethylphenyl)-5-ethyl-pyrazole-4-carboxylic acid CAS Name: 1-(2,5-dimethylphenyl)-5-ethyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(2,5-dimethylphenyl)-5-ethylpyrazole-4-carboxylic acid Traditional Name: 1-(2,5-dimethylphenyl)-5-ethyl-pyrazole-4-carboxylic acid Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=C(C=CC(=C2)C)C)C(=O)O

Isomeric SMILES

CCC1=C(C=NN1C2=C(C=CC(=C2)C)C)C(=O)O

InChI

InChI=1S/C14H16N2O2/c1-4-12-11(14(17)18)8-15-16(12)13-7-9(2)5-6-10(13)3/h5-8H,4H2,1-3H3,(H,17,18)