2-[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]ethanoic acid

Systemtic Name: 2-[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]ethanoic acid Openeye Name: 2-[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]acetic acid CAS Name: 2-[3-(3,4-dimethylphenyl)-1-phenyl-4-pyrazolyl]acetic acid IUPAC Name: 2-[3-(3,4-dimethylphenyl)-1-phenylpyrazol-4-yl]acetic acid Traditional Name: 2-[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]acetic acid Formula: C19H18N2O2 MolecularWeight: 306.35842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2CC(=O)O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2CC(=O)O)C3=CC=CC=C3)C

InChI

InChI=1S/C19H18N2O2/c1-13-8-9-15(10-14(13)2)19-16(11-18(22)23)12-21(20-19)17-6-4-3-5-7-17/h3-10,12H,11H2,1-2H3,(H,22,23)