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

Systemtic Name: 2-[4-[4-[(2-butyl-1-benzofuran-3-yl)methyl]phenyl]phenoxy]-2-phenyl-ethanoic acid Openeye Name: 2-[4-[4-[(2-butylbenzofuran-3-yl)methyl]phenyl]phenoxy]-2-phenyl-acetic acid CAS Name: 2-[4-[4-[(2-butyl-3-benzofuranyl)methyl]phenyl]phenoxy]-2-phenylacetic acid IUPAC Name: 2-[4-[4-[(2-butyl-1-benzofuran-3-yl)methyl]phenyl]phenoxy]-2-phenylacetic acid Traditional Name: 2-[4-[4-[(2-butylbenzofuran-3-yl)methyl]phenyl]phenoxy]-2-phenyl-acetic acid Formula: C33H30O4 MolecularWeight: 490.5889

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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)OC(C5=CC=CC=C5)C(=O)O

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)CC3=CC=C(C=C3)C4=CC=C(C=C4)OC(C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C33H30O4/c1-2-3-12-31-29(28-11-7-8-13-30(28)37-31)22-23-14-16-24(17-15-23)25-18-20-27(21-19-25)36-32(33(34)35)26-9-5-4-6-10-26/h4-11,13-21,32H,2-3,12,22H2,1H3,(H,34,35)