2-[6-[3-(3,3-dimethylbutanoyl)-1-benzofuran-2-yl]naphthalen-2-yl]oxyethanoic acid

Systemtic Name: 2-[6-[3-(3,3-dimethylbutanoyl)-1-benzofuran-2-yl]naphthalen-2-yl]oxyethanoic acid Openeye Name: 2-[[6-[3-(3,3-dimethylbutanoyl)benzofuran-2-yl]-2-naphthyl]oxy]acetic acid CAS Name: 2-[[6-[3-(3,3-dimethyl-1-oxobutyl)-2-benzofuranyl]-2-naphthalenyl]oxy]acetic acid IUPAC Name: 2-[6-[3-(3,3-dimethylbutanoyl)-1-benzofuran-2-yl]naphthalen-2-yl]oxyacetic acid Traditional Name: 2-[6-[3-(3,3-dimethylbutanoyl)benzofuran-2-yl]-2-naphthoxy]acetic acid Formula: C26H24O5 MolecularWeight: 416.46576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)C1=C(OC2=CC=CC=C21)C3=CC4=C(C=C3)C=C(C=C4)OCC(=O)O

Isomeric SMILES

CC(C)(C)CC(=O)C1=C(OC2=CC=CC=C21)C3=CC4=C(C=C3)C=C(C=C4)OCC(=O)O

InChI

InChI=1S/C26H24O5/c1-26(2,3)14-21(27)24-20-6-4-5-7-22(20)31-25(24)18-9-8-17-13-19(30-15-23(28)29)11-10-16(17)12-18/h4-13H,14-15H2,1-3H3,(H,28,29)