3-[2-[5-(bromomethyloxy)-2-methoxy-phenyl]-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one

Systemtic Name: 3-[2-[5-(bromomethyloxy)-2-methoxy-phenyl]-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one Openeye Name: 3-[2-[5-(bromomethoxy)-2-methoxy-phenyl]-2-oxo-ethyl]-3H-isobenzofuran-1-one CAS Name: 3-[2-[5-(bromomethoxy)-2-methoxyphenyl]-2-oxoethyl]-3H-isobenzofuran-1-one IUPAC Name: 3-[2-[5-(bromomethoxy)-2-methoxyphenyl]-2-oxoethyl]-3H-2-benzofuran-1-one Traditional Name: 3-[2-[5-(bromomethoxy)-2-methoxy-phenyl]-2-keto-ethyl]phthalide Formula: C18H15BrO5 MolecularWeight: 391.2127

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)OCBr)C(=O)CC2C3=CC=CC=C3C(=O)O2

Isomeric SMILES

COC1=C(C=C(C=C1)OCBr)C(=O)CC2C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C18H15BrO5/c1-22-16-7-6-11(23-10-19)8-14(16)15(20)9-17-12-4-2-3-5-13(12)18(21)24-17/h2-8,17H,9-10H2,1H3