7-ethanoyl-3-iodanyl-2-oxidanyl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 7-ethanoyl-3-iodanyl-2-oxidanyl-cyclohepta-2,4,6-trien-1-one Openeye Name: 7-acetyl-2-hydroxy-3-iodo-cyclohepta-2,4,6-trien-1-one CAS Name: 7-acetyl-2-hydroxy-3-iodo-1-cyclohepta-2,4,6-trienone IUPAC Name: 7-acetyl-2-hydroxy-3-iodocyclohepta-2,4,6-trien-1-one Traditional Name: 7-acetyl-2-hydroxy-3-iodo-cyclohepta-2,4,6-trien-1-one Formula: C9H7IO3 MolecularWeight: 290.05455

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC(=C(C1=O)O)I

Isomeric SMILES

CC(=O)C1=CC=CC(=C(C1=O)O)I

InChI

InChI=1S/C9H7IO3/c1-5(11)6-3-2-4-7(10)9(13)8(6)12/h2-4H,1H3,(H,12,13)