[2-[3-(4-bromophenyl)-2-(phenylcarbonyl)-3,4-dihydropyrazol-5-yl]phenyl] benzoate

Systemtic Name: [2-[3-(4-bromophenyl)-2-(phenylcarbonyl)-3,4-dihydropyrazol-5-yl]phenyl] benzoate Openeye Name: [2-[2-benzoyl-3-(4-bromophenyl)-3,4-dihydropyrazol-5-yl]phenyl] benzoate CAS Name: benzoic acid [2-[2-benzoyl-3-(4-bromophenyl)-3,4-dihydropyrazol-5-yl]phenyl] ester IUPAC Name: [2-[2-benzoyl-3-(4-bromophenyl)-3,4-dihydropyrazol-5-yl]phenyl] benzoate Traditional Name: benzoic acid [2-[1-benzoyl-5-(4-bromophenyl)-2-pyrazolin-3-yl]phenyl] ester Formula: C29H21BrN2O3 MolecularWeight: 525.39264

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CC=C2OC(=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4)C5=CC=C(C=C5)Br

Isomeric SMILES

C1C(N(N=C1C2=CC=CC=C2OC(=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4)C5=CC=C(C=C5)Br

InChI

InChI=1S/C29H21BrN2O3/c30-23-17-15-20(16-18-23)26-19-25(31-32(26)28(33)21-9-3-1-4-10-21)24-13-7-8-14-27(24)35-29(34)22-11-5-2-6-12-22/h1-18,26H,19H2