3-[2-(5-chloranyl-2-oxidanyl-phenyl)-2-oxidanylidene-ethyl]-6,7-dimethoxy-3H-2-benzofuran-1-one

Systemtic Name: 3-[2-(5-chloranyl-2-oxidanyl-phenyl)-2-oxidanylidene-ethyl]-6,7-dimethoxy-3H-2-benzofuran-1-one Openeye Name: 3-[2-(5-chloro-2-hydroxy-phenyl)-2-oxo-ethyl]-6,7-dimethoxy-3H-isobenzofuran-1-one CAS Name: 3-[2-(5-chloro-2-hydroxyphenyl)-2-oxoethyl]-6,7-dimethoxy-3H-isobenzofuran-1-one IUPAC Name: 3-[2-(5-chloro-2-hydroxyphenyl)-2-oxoethyl]-6,7-dimethoxy-3H-2-benzofuran-1-one Traditional Name: 3-[2-(5-chloro-2-hydroxy-phenyl)-2-keto-ethyl]-6,7-dimethoxy-phthalide Formula: C18H15ClO6 MolecularWeight: 362.7611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClO6/c1-23-14-6-4-10-15(25-18(22)16(10)17(14)24-2)8-13(21)11-7-9(19)3-5-12(11)20/h3-7,15,20H,8H2,1-2H3