methyl 3-[[4-bromanyl-3,5-bis(4-fluorophenyl)pyrazol-1-yl]methyl]benzoate

Systemtic Name: methyl 3-[[4-bromanyl-3,5-bis(4-fluorophenyl)pyrazol-1-yl]methyl]benzoate Openeye Name: methyl 3-[[4-bromo-3,5-bis(4-fluorophenyl)pyrazol-1-yl]methyl]benzoate CAS Name: 3-[[4-bromo-3,5-bis(4-fluorophenyl)-1-pyrazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-bromo-3,5-bis(4-fluorophenyl)pyrazol-1-yl]methyl]benzoate Traditional Name: 3-[[4-bromo-3,5-bis(4-fluorophenyl)pyrazol-1-yl]methyl]benzoic acid methyl ester Formula: C24H17BrF2N2O2 MolecularWeight: 483.304786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CN2C(=C(C(=N2)C3=CC=C(C=C3)F)Br)C4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CN2C(=C(C(=N2)C3=CC=C(C=C3)F)Br)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H17BrF2N2O2/c1-31-24(30)18-4-2-3-15(13-18)14-29-23(17-7-11-20(27)12-8-17)21(25)22(28-29)16-5-9-19(26)10-6-16/h2-13H,14H2,1H3