4-(1,3-benzodioxol-5-yl)-2-(7-methoxy-2-methyl-1-benzofuran-4-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-(7-methoxy-2-methyl-1-benzofuran-4-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-(7-methoxy-2-methyl-benzofuran-4-yl)-4-oxo-butanoic acid CAS Name: 4-(1,3-benzodioxol-5-yl)-2-(7-methoxy-2-methyl-4-benzofuranyl)-4-oxobutanoic acid IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-(7-methoxy-2-methyl-1-benzofuran-4-yl)-4-oxobutanoic acid Traditional Name: 4-(1,3-benzodioxol-5-yl)-4-keto-2-(7-methoxy-2-methyl-benzofuran-4-yl)butyric acid Formula: C21H18O7 MolecularWeight: 382.36342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC(=C2O1)OC)C(CC(=O)C3=CC4=C(C=C3)OCO4)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC(=C2O1)OC)C(CC(=O)C3=CC4=C(C=C3)OCO4)C(=O)O

InChI

InChI=1S/C21H18O7/c1-11-7-14-13(4-6-18(25-2)20(14)28-11)15(21(23)24)9-16(22)12-3-5-17-19(8-12)27-10-26-17/h3-8,15H,9-10H2,1-2H3,(H,23,24)