4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-6,7-dimethoxy-3a,4,9,9a-tetrahydro-1H-benzo[f][2]benzofuran-3-one

Systemtic Name: 4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-6,7-dimethoxy-3a,4,9,9a-tetrahydro-1H-benzo[f][2]benzofuran-3-one Openeye Name: 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-6,7-dimethoxy-3a,4,9,9a-tetrahydro-1H-benzo[f]isobenzofuran-3-one CAS Name: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-6,7-dimethoxy-3a,4,9,9a-tetrahydro-1H-benzo[f]isobenzofuran-3-one IUPAC Name: 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-6,7-dimethoxy-3a,4,9,9a-tetrahydro-1H-benzo[f][2]benzofuran-3-one Traditional Name: 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-6,7-dimethoxy-3a,4,9,9a-tetrahydro-1H-benz[f]isobenzofuran-3-one Formula: C21H21BrO6 MolecularWeight: 449.29184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(C3C(CC2=C1)COC3=O)C4=CC(=C(C(=C4)Br)O)OC)OC

Isomeric SMILES

COC1=C(C=C2C(C3C(CC2=C1)COC3=O)C4=CC(=C(C(=C4)Br)O)OC)OC

InChI

InChI=1S/C21H21BrO6/c1-25-15-6-10-4-12-9-28-21(24)19(12)18(13(10)8-16(15)26-2)11-5-14(22)20(23)17(7-11)27-3/h5-8,12,18-19,23H,4,9H2,1-3H3