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

Systemtic Name: 3,7-bis(bromanyl)-5-(methoxymethyl)-2-oxidanyl-cyclohepta-2,4,6-trien-1-one Openeye Name: 3,7-dibromo-2-hydroxy-5-(methoxymethyl)cyclohepta-2,4,6-trien-1-one CAS Name: 3,7-dibromo-2-hydroxy-5-(methoxymethyl)-1-cyclohepta-2,4,6-trienone IUPAC Name: 3,7-dibromo-2-hydroxy-5-(methoxymethyl)cyclohepta-2,4,6-trien-1-one Traditional Name: 3,7-dibromo-2-hydroxy-5-(methoxymethyl)cyclohepta-2,4,6-trien-1-one Formula: C9H8Br2O3 MolecularWeight: 323.96602

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC(=C(C(=O)C(=C1)Br)O)Br

Isomeric SMILES

COCC1=CC(=C(C(=O)C(=C1)Br)O)Br

InChI

InChI=1S/C9H8Br2O3/c1-14-4-5-2-6(10)8(12)9(13)7(11)3-5/h2-3H,4H2,1H3,(H,12,13)