2-[2-(4-bromophenyl)sulfonylethylsulfanyl]propanoic acid

Systemtic Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]propanoic acid Openeye Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]propanoic acid CAS Name: 2-[2-(4-bromophenyl)sulfonylethylthio]propanoic acid IUPAC Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]propanoic acid Traditional Name: 2-(2-brosylethylthio)propionic acid Formula: C11H13BrO4S2 MolecularWeight: 353.25252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCCS(=O)(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CC(C(=O)O)SCCS(=O)(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C11H13BrO4S2/c1-8(11(13)14)17-6-7-18(15,16)10-4-2-9(12)3-5-10/h2-5,8H,6-7H2,1H3,(H,13,14)