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

Systemtic Name: [2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl] 3-bromanylbenzoate Openeye Name: [2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-(2-chlorophenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(2-chlorophenyl)-5-phenylpyrazol-3-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl] ester Formula: C22H14BrClN2O2 MolecularWeight: 453.71576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=C2)OC(=O)C3=CC(=CC=C3)Br)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=C2)OC(=O)C3=CC(=CC=C3)Br)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H14BrClN2O2/c23-17-10-6-9-16(13-17)22(27)28-21-14-19(15-7-2-1-3-8-15)25-26(21)20-12-5-4-11-18(20)24/h1-14H