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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(OC2=CC=CC=C21)C3=CC4=C(C=C3)C(=C(C=C4)OCC(=O)O)Br

Isomeric SMILES

CCCCCC1=C(OC2=CC=CC=C21)C3=CC4=C(C=C3)C(=C(C=C4)OCC(=O)O)Br

InChI

InChI=1S/C25H23BrO4/c1-2-3-4-8-20-19-7-5-6-9-21(19)30-25(20)17-10-12-18-16(14-17)11-13-22(24(18)26)29-15-23(27)28/h5-7,9-14H,2-4,8,15H2,1H3,(H,27,28)