7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate

Systemtic Name: 7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate Openeye Name: 7-bromo-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate CAS Name: 7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylate IUPAC Name: 7-bromo-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate Traditional Name: 7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylate Formula: C10H8BrO4- MolecularWeight: 272.07212

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C(=C2)C(=O)[O-])Br)OC1

Isomeric SMILES

C1COC2=C(C=C(C(=C2)C(=O)[O-])Br)OC1

InChI

InChI=1S/C10H9BrO4/c11-7-5-9-8(4-6(7)10(12)13)14-2-1-3-15-9/h4-5H,1-3H2,(H,12,13)/p-1