2-[6-methoxy-7-(4-methylphenyl)carbonyl-1-benzofuran-5-yl]propanoic acid

Systemtic Name: 2-[6-methoxy-7-(4-methylphenyl)carbonyl-1-benzofuran-5-yl]propanoic acid Openeye Name: 2-[6-methoxy-7-(4-methylbenzoyl)benzofuran-5-yl]propanoic acid CAS Name: 2-[6-methoxy-7-[(4-methylphenyl)-oxomethyl]-5-benzofuranyl]propanoic acid IUPAC Name: 2-[6-methoxy-7-(4-methylbenzoyl)-1-benzofuran-5-yl]propanoic acid Traditional Name: 2-(6-methoxy-7-p-toluoyl-benzofuran-5-yl)propionic acid Formula: C20H18O5 MolecularWeight: 338.35392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C3C(=CC(=C2OC)C(C)C(=O)O)C=CO3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C3C(=CC(=C2OC)C(C)C(=O)O)C=CO3

InChI

InChI=1S/C20H18O5/c1-11-4-6-13(7-5-11)17(21)16-18-14(8-9-25-18)10-15(19(16)24-3)12(2)20(22)23/h4-10,12H,1-3H3,(H,22,23)