[2-[1-(4-methylphenyl)pyrazol-4-yl]carbonylphenyl] 3-bromanylbenzoate

Systemtic Name: [2-[1-(4-methylphenyl)pyrazol-4-yl]carbonylphenyl] 3-bromanylbenzoate Openeye Name: [2-[1-(p-tolyl)pyrazole-4-carbonyl]phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-[[1-(4-methylphenyl)-4-pyrazolyl]-oxomethyl]phenyl] ester IUPAC Name: [2-[1-(4-methylphenyl)pyrazole-4-carbonyl]phenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [2-[1-(p-tolyl)pyrazole-4-carbonyl]phenyl] ester Formula: C24H17BrN2O3 MolecularWeight: 461.30738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C=N2)C(=O)C3=CC=CC=C3OC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C=N2)C(=O)C3=CC=CC=C3OC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C24H17BrN2O3/c1-16-9-11-20(12-10-16)27-15-18(14-26-27)23(28)21-7-2-3-8-22(21)30-24(29)17-5-4-6-19(25)13-17/h2-15H,1H3