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

Systemtic Name: (2-fluorophenyl)methyl 4-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]benzoate Openeye Name: (2-fluorophenyl)methyl 4-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]benzoate CAS Name: 4-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]benzoic acid (2-fluorophenyl)methyl ester IUPAC Name: (2-fluorophenyl)methyl 4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzoate Traditional Name: 4-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]benzoic acid (2-fluorobenzyl) ester Formula: C20H18BrFN2O2 MolecularWeight: 417.271523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3F)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3F)C)Br

InChI

InChI=1S/C20H18BrFN2O2/c1-13-19(21)14(2)24(23-13)11-15-7-9-16(10-8-15)20(25)26-12-17-5-3-4-6-18(17)22/h3-10H,11-12H2,1-2H3