(2-butylsulfanylphenyl) 2-bromanylethanoate

Systemtic Name: (2-butylsulfanylphenyl) 2-bromanylethanoate Openeye Name: (2-butylsulfanylphenyl) 2-bromoacetate CAS Name: 2-bromoacetic acid [2-(butylthio)phenyl] ester IUPAC Name: (2-butylsulfanylphenyl) 2-bromoacetate Traditional Name: 2-bromoacetic acid [2-(butylthio)phenyl] ester Formula: C12H15BrO2S MolecularWeight: 303.2153

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=CC=C1OC(=O)CBr

Isomeric SMILES

CCCCSC1=CC=CC=C1OC(=O)CBr

InChI

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