(2-bromophenyl)methyl 3-(4-fluorophenyl)sulfonylpropanoate

Systemtic Name: (2-bromophenyl)methyl 3-(4-fluorophenyl)sulfonylpropanoate Openeye Name: (2-bromophenyl)methyl 3-(4-fluorophenyl)sulfonylpropanoate CAS Name: 3-(4-fluorophenyl)sulfonylpropanoic acid (2-bromophenyl)methyl ester IUPAC Name: (2-bromophenyl)methyl 3-(4-fluorophenyl)sulfonylpropanoate Traditional Name: 3-(4-fluorophenyl)sulfonylpropionic acid (2-bromobenzyl) ester Formula: C16H14BrFO4S MolecularWeight: 401.247363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F)Br

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F)Br

InChI

InChI=1S/C16H14BrFO4S/c17-15-4-2-1-3-12(15)11-22-16(19)9-10-23(20,21)14-7-5-13(18)6-8-14/h1-8H,9-11H2