methyl (2R)-2-[[2-[(3,4-dimethoxyphenyl)methylidene]-7-methyl-3-oxidanylidene-1-benzofuran-6-yl]oxy]propanoate

Systemtic Name: methyl (2R)-2-[[2-[(3,4-dimethoxyphenyl)methylidene]-7-methyl-3-oxidanylidene-1-benzofuran-6-yl]oxy]propanoate Openeye Name: methyl (2R)-2-[2-[(3,4-dimethoxyphenyl)methylene]-7-methyl-3-oxo-benzofuran-6-yl]oxypropanoate CAS Name: (2R)-2-[[2-[(3,4-dimethoxyphenyl)methylidene]-7-methyl-3-oxo-6-benzofuranyl]oxy]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[(3,4-dimethoxyphenyl)methylidene]-7-methyl-3-oxo-1-benzofuran-6-yl]oxy]propanoate Traditional Name: (2R)-2-(3-keto-7-methyl-2-veratrylidene-coumaran-6-yl)oxypropionic acid methyl ester Formula: C22H22O7 MolecularWeight: 398.40588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=CC3=CC(=C(C=C3)OC)OC)C2=O)OC(C)C(=O)OC

Isomeric SMILES

CC1=C(C=CC2=C1OC(=CC3=CC(=C(C=C3)OC)OC)C2=O)O[C@H](C)C(=O)OC

InChI

InChI=1S/C22H22O7/c1-12-16(28-13(2)22(24)27-5)9-7-15-20(23)19(29-21(12)15)11-14-6-8-17(25-3)18(10-14)26-4/h6-11,13H,1-5H3/t13-/m1/s1