3-[(5-ethanoyl-4-methoxy-6-oxidanyl-1-benzofuran-7-yl)oxymethyl]benzoic acid

Systemtic Name: 3-[(5-ethanoyl-4-methoxy-6-oxidanyl-1-benzofuran-7-yl)oxymethyl]benzoic acid Openeye Name: 3-[(5-acetyl-6-hydroxy-4-methoxy-benzofuran-7-yl)oxymethyl]benzoic acid CAS Name: 3-[(5-acetyl-6-hydroxy-4-methoxy-7-benzofuranyl)oxymethyl]benzoic acid IUPAC Name: 3-[(5-acetyl-6-hydroxy-4-methoxy-1-benzofuran-7-yl)oxymethyl]benzoic acid Traditional Name: 3-[(5-acetyl-6-hydroxy-4-methoxy-benzofuran-7-yl)oxymethyl]benzoic acid Formula: C19H16O7 MolecularWeight: 356.32614

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C2=C(C(=C1O)OCC3=CC=CC(=C3)C(=O)O)OC=C2)OC

Isomeric SMILES

CC(=O)C1=C(C2=C(C(=C1O)OCC3=CC=CC(=C3)C(=O)O)OC=C2)OC

InChI

InChI=1S/C19H16O7/c1-10(20)14-15(21)18(17-13(6-7-25-17)16(14)24-2)26-9-11-4-3-5-12(8-11)19(22)23/h3-8,21H,9H2,1-2H3,(H,22,23)