1-[4-(3-bromanylpropoxy)-3-methyl-2-sulfanyl-phenyl]ethanone

Systemtic Name: 1-[4-(3-bromanylpropoxy)-3-methyl-2-sulfanyl-phenyl]ethanone Openeye Name: 1-[4-(3-bromopropoxy)-3-methyl-2-sulfanyl-phenyl]ethanone CAS Name: 1-[4-(3-bromopropoxy)-2-mercapto-3-methylphenyl]ethanone IUPAC Name: 1-[4-(3-bromopropoxy)-3-methyl-2-sulfanylphenyl]ethanone Traditional Name: 1-[4-(3-bromopropoxy)-2-mercapto-3-methyl-phenyl]ethanone Formula: C12H15BrO2S MolecularWeight: 303.2153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1S)C(=O)C)OCCCBr

Isomeric SMILES

CC1=C(C=CC(=C1S)C(=O)C)OCCCBr

InChI

InChI=1S/C12H15BrO2S/c1-8-11(15-7-3-6-13)5-4-10(9(2)14)12(8)16/h4-5,16H,3,6-7H2,1-2H3