3-[2-(3,4-dimethoxyphenyl)-2-oxidanyl-ethyl]-3H-2-benzofuran-1-one

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)-2-oxidanyl-ethyl]-3H-2-benzofuran-1-one Openeye Name: 3-[2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]-3H-isobenzofuran-1-one CAS Name: 3-[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]-3H-isobenzofuran-1-one IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]-3H-2-benzofuran-1-one Traditional Name: 3-[2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]phthalide Formula: C18H18O5 MolecularWeight: 314.33252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18O5/c1-21-15-8-7-11(9-17(15)22-2)14(19)10-16-12-5-3-4-6-13(12)18(20)23-16/h3-9,14,16,19H,10H2,1-2H3