1-[2-(3-bromanylpropoxy)-3-sulfanyl-phenyl]ethanone

Systemtic Name: 1-[2-(3-bromanylpropoxy)-3-sulfanyl-phenyl]ethanone Openeye Name: 1-[2-(3-bromopropoxy)-3-sulfanyl-phenyl]ethanone CAS Name: 1-[2-(3-bromopropoxy)-3-mercaptophenyl]ethanone IUPAC Name: 1-[2-(3-bromopropoxy)-3-sulfanylphenyl]ethanone Traditional Name: 1-[2-(3-bromopropoxy)-3-mercapto-phenyl]ethanone Formula: C11H13BrO2S MolecularWeight: 289.18872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=CC=C1)S)OCCCBr

Isomeric SMILES

CC(=O)C1=C(C(=CC=C1)S)OCCCBr

InChI

InChI=1S/C11H13BrO2S/c1-8(13)9-4-2-5-10(15)11(9)14-7-3-6-12/h2,4-5,15H,3,6-7H2,1H3