[(E)-3-bromanylbut-2-en-2-yl] 2-phenylethanoate

Systemtic Name: [(E)-3-bromanylbut-2-en-2-yl] 2-phenylethanoate Openeye Name: [(E)-2-bromo-1-methyl-prop-1-enyl] 2-phenylacetate CAS Name: 2-phenylacetic acid [(E)-3-bromobut-2-en-2-yl] ester IUPAC Name: [(E)-3-bromobut-2-en-2-yl] 2-phenylacetate Traditional Name: 2-phenylacetic acid [(E)-2-bromo-1-methyl-prop-1-enyl] ester Formula: C12H13BrO2 MolecularWeight: 269.13442

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C)Br)OC(=O)CC1=CC=CC=C1

Isomeric SMILES

C/C(=C(/C)\Br)/OC(=O)CC1=CC=CC=C1

InChI

InChI=1S/C12H13BrO2/c1-9(13)10(2)15-12(14)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3/b10-9+