[(E)-4-phenylsulfanylbut-3-enyl] 2-bromanylethanoate

Systemtic Name: [(E)-4-phenylsulfanylbut-3-enyl] 2-bromanylethanoate Openeye Name: [(E)-4-phenylsulfanylbut-3-enyl] 2-bromoacetate CAS Name: 2-bromoacetic acid [(E)-4-(phenylthio)but-3-enyl] ester IUPAC Name: [(E)-4-phenylsulfanylbut-3-enyl] 2-bromoacetate Traditional Name: 2-bromoacetic acid [(E)-4-(phenylthio)but-3-enyl] ester Formula: C12H13BrO2S MolecularWeight: 301.19942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC=CCCOC(=O)CBr

Isomeric SMILES

C1=CC=C(C=C1)S/C=C/CCOC(=O)CBr

InChI

InChI=1S/C12H13BrO2S/c13-10-12(14)15-8-4-5-9-16-11-6-2-1-3-7-11/h1-3,5-7,9H,4,8,10H2/b9-5+