[2-acetyloxy-4-[(E)-3-bromanylprop-2-enyl]phenyl] ethanoate

Systemtic Name: [2-acetyloxy-4-[(E)-3-bromanylprop-2-enyl]phenyl] ethanoate Openeye Name: [2-acetoxy-4-[(E)-3-bromoallyl]phenyl] acetate CAS Name: acetic acid [2-acetyloxy-4-[(E)-3-bromoprop-2-enyl]phenyl] ester IUPAC Name: [2-acetyloxy-4-[(E)-3-bromoprop-2-enyl]phenyl] acetate Traditional Name: acetic acid [2-acetoxy-4-[(E)-3-bromoallyl]phenyl] ester Formula: C13H13BrO4 MolecularWeight: 313.14392

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)CC=CBr)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C/C=C/Br)OC(=O)C

InChI

InChI=1S/C13H13BrO4/c1-9(15)17-12-6-5-11(4-3-7-14)8-13(12)18-10(2)16/h3,5-8H,4H2,1-2H3/b7-3+