2-(4-bromanylphenoxy)ethyl 3-(methylsulfonylmethyl)benzoate

Systemtic Name: 2-(4-bromanylphenoxy)ethyl 3-(methylsulfonylmethyl)benzoate Openeye Name: 2-(4-bromophenoxy)ethyl 3-(methylsulfonylmethyl)benzoate CAS Name: 3-(methylsulfonylmethyl)benzoic acid 2-(4-bromophenoxy)ethyl ester IUPAC Name: 2-(4-bromophenoxy)ethyl 3-(methylsulfonylmethyl)benzoate Traditional Name: 3-(mesylmethyl)benzoic acid 2-(4-bromophenoxy)ethyl ester Formula: C17H17BrO5S MolecularWeight: 413.28288

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)OCCOC2=CC=C(C=C2)Br

Isomeric SMILES

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)OCCOC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H17BrO5S/c1-24(20,21)12-13-3-2-4-14(11-13)17(19)23-10-9-22-16-7-5-15(18)6-8-16/h2-8,11H,9-10,12H2,1H3