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

Systemtic Name: 2-[1-(3-bromophenyl)-3,5-diphenyl-pyrazol-4-yl]ethanoic acid Openeye Name: 2-[1-(3-bromophenyl)-3,5-diphenyl-pyrazol-4-yl]acetic acid CAS Name: 2-[1-(3-bromophenyl)-3,5-diphenyl-4-pyrazolyl]acetic acid IUPAC Name: 2-[1-(3-bromophenyl)-3,5-diphenylpyrazol-4-yl]acetic acid Traditional Name: 2-[1-(3-bromophenyl)-3,5-diphenyl-pyrazol-4-yl]acetic acid Formula: C23H17BrN2O2 MolecularWeight: 433.29728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NN2C3=CC(=CC=C3)Br)C4=CC=CC=C4)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NN2C3=CC(=CC=C3)Br)C4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C23H17BrN2O2/c24-18-12-7-13-19(14-18)26-23(17-10-5-2-6-11-17)20(15-21(27)28)22(25-26)16-8-3-1-4-9-16/h1-14H,15H2,(H,27,28)