3-(3-bromanyl-4-oxidanyl-phenyl)-6,7-dimethoxy-3H-2-benzofuran-1-one

Systemtic Name: 3-(3-bromanyl-4-oxidanyl-phenyl)-6,7-dimethoxy-3H-2-benzofuran-1-one Openeye Name: 3-(3-bromo-4-hydroxy-phenyl)-6,7-dimethoxy-3H-isobenzofuran-1-one CAS Name: 3-(3-bromo-4-hydroxyphenyl)-6,7-dimethoxy-3H-isobenzofuran-1-one IUPAC Name: 3-(3-bromo-4-hydroxyphenyl)-6,7-dimethoxy-3H-2-benzofuran-1-one Traditional Name: 3-(3-bromo-4-hydroxy-phenyl)-6,7-dimethoxy-phthalide Formula: C16H13BrO5 MolecularWeight: 365.17542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrO5/c1-20-12-6-4-9-13(15(12)21-2)16(19)22-14(9)8-3-5-11(18)10(17)7-8/h3-7,14,18H,1-2H3