3,5-bis(bromanyl)-7-ethanoyl-2-oxidanyl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 3,5-bis(bromanyl)-7-ethanoyl-2-oxidanyl-cyclohepta-2,4,6-trien-1-one Openeye Name: 7-acetyl-3,5-dibromo-2-hydroxy-cyclohepta-2,4,6-trien-1-one CAS Name: 7-acetyl-3,5-dibromo-2-hydroxy-1-cyclohepta-2,4,6-trienone IUPAC Name: 7-acetyl-3,5-dibromo-2-hydroxycyclohepta-2,4,6-trien-1-one Traditional Name: 7-acetyl-3,5-dibromo-2-hydroxy-cyclohepta-2,4,6-trien-1-one Formula: C9H6Br2O3 MolecularWeight: 321.95014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6Br2O3/c1-4(12)6-2-5(10)3-7(11)9(14)8(6)13/h2-3H,1H3,(H,13,14)