3-[4-(1-benzofuran-2-yl)phenoxy]octanoic acid

Systemtic Name: 3-[4-(1-benzofuran-2-yl)phenoxy]octanoic acid Openeye Name: 3-[4-(benzofuran-2-yl)phenoxy]octanoic acid CAS Name: 3-[4-(2-benzofuranyl)phenoxy]octanoic acid IUPAC Name: 3-[4-(1-benzofuran-2-yl)phenoxy]octanoic acid Traditional Name: 3-[4-(benzofuran-2-yl)phenoxy]caprylic acid Formula: C22H24O4 MolecularWeight: 352.42356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)O)OC1=CC=C(C=C1)C2=CC3=CC=CC=C3O2

Isomeric SMILES

CCCCCC(CC(=O)O)OC1=CC=C(C=C1)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C22H24O4/c1-2-3-4-8-19(15-22(23)24)25-18-12-10-16(11-13-18)21-14-17-7-5-6-9-20(17)26-21/h5-7,9-14,19H,2-4,8,15H2,1H3,(H,23,24)