ethyl 4-bromanyl-5-methyl-1-[3-[2-(trifluoromethyloxy)phenyl]phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 4-bromanyl-5-methyl-1-[3-[2-(trifluoromethyloxy)phenyl]phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 4-bromo-5-methyl-1-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyrazole-3-carboxylate CAS Name: 4-bromo-5-methyl-1-[3-[2-(trifluoromethoxy)phenyl]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-bromo-5-methyl-1-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyrazole-3-carboxylate Traditional Name: 4-bromo-5-methyl-1-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C20H16BrF3N2O3 MolecularWeight: 469.25185

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1Br)C)C2=CC=CC(=C2)C3=CC=CC=C3OC(F)(F)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1Br)C)C2=CC=CC(=C2)C3=CC=CC=C3OC(F)(F)F

InChI

InChI=1S/C20H16BrF3N2O3/c1-3-28-19(27)18-17(21)12(2)26(25-18)14-8-6-7-13(11-14)15-9-4-5-10-16(15)29-20(22,23)24/h4-11H,3H2,1-2H3