3-[1-methyl-3-(4-methylphenyl)pyrazol-4-yl]propanoic acid

Systemtic Name: 3-[1-methyl-3-(4-methylphenyl)pyrazol-4-yl]propanoic acid Openeye Name: 3-[1-methyl-3-(p-tolyl)pyrazol-4-yl]propanoic acid CAS Name: 3-[1-methyl-3-(4-methylphenyl)-4-pyrazolyl]propanoic acid IUPAC Name: 3-[1-methyl-3-(4-methylphenyl)pyrazol-4-yl]propanoic acid Traditional Name: 3-[1-methyl-3-(p-tolyl)pyrazol-4-yl]propionic acid Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2CCC(=O)O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2CCC(=O)O)C

InChI

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