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

Systemtic Name: 3-[3-(3,4-dimethylphenyl)-1-methyl-pyrazol-4-yl]propanoic acid Openeye Name: 3-[3-(3,4-dimethylphenyl)-1-methyl-pyrazol-4-yl]propanoic acid CAS Name: 3-[3-(3,4-dimethylphenyl)-1-methyl-4-pyrazolyl]propanoic acid IUPAC Name: 3-[3-(3,4-dimethylphenyl)-1-methylpyrazol-4-yl]propanoic acid Traditional Name: 3-[3-(3,4-dimethylphenyl)-1-methyl-pyrazol-4-yl]propionic acid Formula: C15H18N2O2 MolecularWeight: 258.31562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O2/c1-10-4-5-12(8-11(10)2)15-13(6-7-14(18)19)9-17(3)16-15/h4-5,8-9H,6-7H2,1-3H3,(H,18,19)