[2-bromanyl-1-(1,5-dihydro-2,4-benzodioxepin-3-yl)ethyl] ethanoate

Systemtic Name: [2-bromanyl-1-(1,5-dihydro-2,4-benzodioxepin-3-yl)ethyl] ethanoate Openeye Name: [2-bromo-1-(1,5-dihydro-2,4-benzodioxepin-3-yl)ethyl] acetate CAS Name: acetic acid [2-bromo-1-(1,5-dihydro-2,4-benzodioxepin-3-yl)ethyl] ester IUPAC Name: [2-bromo-1-(1,5-dihydro-2,4-benzodioxepin-3-yl)ethyl] acetate Traditional Name: acetic acid [2-bromo-1-(1,5-dihydro-2,4-benzodioxepin-3-yl)ethyl] ester Formula: C13H15BrO4 MolecularWeight: 315.1598

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CBr)C1OCC2=CC=CC=C2CO1

Isomeric SMILES

CC(=O)OC(CBr)C1OCC2=CC=CC=C2CO1

InChI

InChI=1S/C13H15BrO4/c1-9(15)18-12(6-14)13-16-7-10-4-2-3-5-11(10)8-17-13/h2-5,12-13H,6-8H2,1H3