9-(1,3-benzodioxol-5-yl)-5-bromanyl-6,7,8-trimethoxy-1H-benzo[f][2]benzofuran-3-one

Systemtic Name: 9-(1,3-benzodioxol-5-yl)-5-bromanyl-6,7,8-trimethoxy-1H-benzo[f][2]benzofuran-3-one Openeye Name: 9-(1,3-benzodioxol-5-yl)-5-bromo-6,7,8-trimethoxy-1H-benzo[f]isobenzofuran-3-one CAS Name: 9-(1,3-benzodioxol-5-yl)-5-bromo-6,7,8-trimethoxy-1H-benzo[f]isobenzofuran-3-one IUPAC Name: 9-(1,3-benzodioxol-5-yl)-5-bromo-6,7,8-trimethoxy-1H-benzo[f][2]benzofuran-3-one Traditional Name: 9-(1,3-benzodioxol-5-yl)-5-bromo-6,7,8-trimethoxy-1H-benz[f]isobenzofuran-3-one Formula: C22H17BrO7 MolecularWeight: 473.27018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=CC3=C(COC3=O)C(=C21)C4=CC5=C(C=C4)OCO5)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C2=CC3=C(COC3=O)C(=C21)C4=CC5=C(C=C4)OCO5)Br)OC)OC

InChI

InChI=1S/C22H17BrO7/c1-25-19-17-12(18(23)20(26-2)21(19)27-3)7-11-13(8-28-22(11)24)16(17)10-4-5-14-15(6-10)30-9-29-14/h4-7H,8-9H2,1-3H3