2-[1-bromanyl-6-[(2-butyl-1-benzofuran-3-yl)methyl]naphthalen-2-yl]oxyethanoic acid

Systemtic Name: 2-[1-bromanyl-6-[(2-butyl-1-benzofuran-3-yl)methyl]naphthalen-2-yl]oxyethanoic acid Openeye Name: 2-[[1-bromo-6-[(2-butylbenzofuran-3-yl)methyl]-2-naphthyl]oxy]acetic acid CAS Name: 2-[[1-bromo-6-[(2-butyl-3-benzofuranyl)methyl]-2-naphthalenyl]oxy]acetic acid IUPAC Name: 2-[1-bromo-6-[(2-butyl-1-benzofuran-3-yl)methyl]naphthalen-2-yl]oxyacetic acid Traditional Name: 2-[1-bromo-6-[(2-butylbenzofuran-3-yl)methyl]-2-naphthoxy]acetic acid Formula: C25H23BrO4 MolecularWeight: 467.35172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)CC3=CC4=C(C=C3)C(=C(C=C4)OCC(=O)O)Br

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)CC3=CC4=C(C=C3)C(=C(C=C4)OCC(=O)O)Br

InChI

InChI=1S/C25H23BrO4/c1-2-3-7-22-20(19-6-4-5-8-21(19)30-22)14-16-9-11-18-17(13-16)10-12-23(25(18)26)29-15-24(27)28/h4-6,8-13H,2-3,7,14-15H2,1H3,(H,27,28)