3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]propanoic acid

Systemtic Name: 3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]propanoic acid Openeye Name: 3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]propanoic acid CAS Name: 3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]propanoic acid IUPAC Name: 3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]propanoic acid Traditional Name: 3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]propionic acid Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(C=NN2)CCC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(C=NN2)CCC(=O)O

InChI

InChI=1S/C14H16N2O2/c1-2-10-3-5-11(6-4-10)14-12(9-15-16-14)7-8-13(17)18/h3-6,9H,2,7-8H2,1H3,(H,15,16)(H,17,18)