2-[4-[4-[(2-butyl-1-benzofuran-3-yl)methyl]phenyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[4-[(2-butyl-1-benzofuran-3-yl)methyl]phenyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[4-[(2-butylbenzofuran-3-yl)methyl]phenyl]phenoxy]acetic acid CAS Name: 2-[4-[4-[(2-butyl-3-benzofuranyl)methyl]phenyl]phenoxy]acetic acid IUPAC Name: 2-[4-[4-[(2-butyl-1-benzofuran-3-yl)methyl]phenyl]phenoxy]acetic acid Traditional Name: 2-[4-[4-[(2-butylbenzofuran-3-yl)methyl]phenyl]phenoxy]acetic acid Formula: C27H26O4 MolecularWeight: 414.49294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)CC3=CC=C(C=C3)C4=CC=C(C=C4)OCC(=O)O

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)CC3=CC=C(C=C3)C4=CC=C(C=C4)OCC(=O)O

InChI

InChI=1S/C27H26O4/c1-2-3-7-26-24(23-6-4-5-8-25(23)31-26)17-19-9-11-20(12-10-19)21-13-15-22(16-14-21)30-18-27(28)29/h4-6,8-16H,2-3,7,17-18H2,1H3,(H,28,29)