3-(3-bromanyl-2-methoxy-6-oxidanyl-phenyl)-6,7-dimethoxy-3H-2-benzofuran-1-one

Systemtic Name: 3-(3-bromanyl-2-methoxy-6-oxidanyl-phenyl)-6,7-dimethoxy-3H-2-benzofuran-1-one Openeye Name: 3-(3-bromo-6-hydroxy-2-methoxy-phenyl)-6,7-dimethoxy-3H-isobenzofuran-1-one CAS Name: 3-(3-bromo-6-hydroxy-2-methoxyphenyl)-6,7-dimethoxy-3H-isobenzofuran-1-one IUPAC Name: 3-(3-bromo-6-hydroxy-2-methoxyphenyl)-6,7-dimethoxy-3H-2-benzofuran-1-one Traditional Name: 3-(3-bromo-6-hydroxy-2-methoxy-phenyl)-6,7-dimethoxy-phthalide Formula: C17H15BrO6 MolecularWeight: 395.2014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)C3=C(C=CC(=C3OC)Br)O)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)C3=C(C=CC(=C3OC)Br)O)OC

InChI

InChI=1S/C17H15BrO6/c1-21-11-7-4-8-12(16(11)23-3)17(20)24-14(8)13-10(19)6-5-9(18)15(13)22-2/h4-7,14,19H,1-3H3