2-[1-(3,4-dimethylphenyl)-3,5-diphenyl-pyrazol-4-yl]ethanoic acid

Systemtic Name: 2-[1-(3,4-dimethylphenyl)-3,5-diphenyl-pyrazol-4-yl]ethanoic acid Openeye Name: 2-[1-(3,4-dimethylphenyl)-3,5-diphenyl-pyrazol-4-yl]acetic acid CAS Name: 2-[1-(3,4-dimethylphenyl)-3,5-diphenyl-4-pyrazolyl]acetic acid IUPAC Name: 2-[1-(3,4-dimethylphenyl)-3,5-diphenylpyrazol-4-yl]acetic acid Traditional Name: 2-[1-(3,4-dimethylphenyl)-3,5-diphenyl-pyrazol-4-yl]acetic acid Formula: C25H22N2O2 MolecularWeight: 382.45438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C(=N2)C3=CC=CC=C3)CC(=O)O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C(=N2)C3=CC=CC=C3)CC(=O)O)C4=CC=CC=C4)C

InChI

InChI=1S/C25H22N2O2/c1-17-13-14-21(15-18(17)2)27-25(20-11-7-4-8-12-20)22(16-23(28)29)24(26-27)19-9-5-3-6-10-19/h3-15H,16H2,1-2H3,(H,28,29)