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

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]propanoic acid Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]propanoic acid CAS Name: 2-[(4-bromophenyl)methylthio]propanoic acid IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]propanoic acid Traditional Name: 2-[(4-bromobenzyl)thio]propionic acid Formula: C10H11BrO2S MolecularWeight: 275.16214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC1=CC=C(C=C1)Br

Isomeric SMILES

CC(C(=O)O)SCC1=CC=C(C=C1)Br

InChI

InChI=1S/C10H11BrO2S/c1-7(10(12)13)14-6-8-2-4-9(11)5-3-8/h2-5,7H,6H2,1H3,(H,12,13)