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

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-(7-methoxy-2-methyl-1-benzofuran-4-yl)butanoic acid Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-(7-methoxy-2-methyl-benzofuran-4-yl)butanoic acid CAS Name: 4-(1,3-benzodioxol-5-yl)-2-(7-methoxy-2-methyl-4-benzofuranyl)butanoic acid IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-(7-methoxy-2-methyl-1-benzofuran-4-yl)butanoic acid Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-(7-methoxy-2-methyl-benzofuran-4-yl)butyric acid Formula: C21H20O6 MolecularWeight: 368.3799

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC(=C2O1)OC)C(CCC3=CC4=C(C=C3)OCO4)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC(=C2O1)OC)C(CCC3=CC4=C(C=C3)OCO4)C(=O)O

InChI

InChI=1S/C21H20O6/c1-12-9-16-14(6-8-18(24-2)20(16)27-12)15(21(22)23)5-3-13-4-7-17-19(10-13)26-11-25-17/h4,6-10,15H,3,5,11H2,1-2H3,(H,22,23)