5-ethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylic acid

Systemtic Name: 5-ethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylic acid Openeye Name: 5-ethyl-1-(p-tolylmethyl)pyrazole-4-carboxylic acid CAS Name: 5-ethyl-1-[(4-methylphenyl)methyl]-4-pyrazolecarboxylic acid IUPAC Name: 5-ethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylic acid Traditional Name: 5-ethyl-1-(4-methylbenzyl)pyrazole-4-carboxylic acid Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1CC2=CC=C(C=C2)C)C(=O)O

Isomeric SMILES

CCC1=C(C=NN1CC2=CC=C(C=C2)C)C(=O)O

InChI

InChI=1S/C14H16N2O2/c1-3-13-12(14(17)18)8-15-16(13)9-11-6-4-10(2)5-7-11/h4-8H,3,9H2,1-2H3,(H,17,18)