[2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl] 3-bromanylbenzoate

Systemtic Name: [2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl] 3-bromanylbenzoate Openeye Name: [5-phenyl-2-(p-tolyl)pyrazol-3-yl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-(4-methylphenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(4-methylphenyl)-5-phenylpyrazol-3-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [5-phenyl-2-(p-tolyl)pyrazol-3-yl] ester Formula: C23H17BrN2O2 MolecularWeight: 433.29728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H17BrN2O2/c1-16-10-12-20(13-11-16)26-22(15-21(25-26)17-6-3-2-4-7-17)28-23(27)18-8-5-9-19(24)14-18/h2-15H,1H3