4-[2-butanoyloxy-2-(5-tert-butyl-1-benzofuran-2-yl)ethoxy]benzoic acid

Systemtic Name: 4-[2-butanoyloxy-2-(5-tert-butyl-1-benzofuran-2-yl)ethoxy]benzoic acid Openeye Name: 4-[2-butanoyloxy-2-(5-tert-butylbenzofuran-2-yl)ethoxy]benzoic acid CAS Name: 4-[2-(5-tert-butyl-2-benzofuranyl)-2-(1-oxobutoxy)ethoxy]benzoic acid IUPAC Name: 4-[2-butanoyloxy-2-(5-tert-butyl-1-benzofuran-2-yl)ethoxy]benzoic acid Traditional Name: 4-[2-(5-tert-butylbenzofuran-2-yl)-2-butyryloxy-ethoxy]benzoic acid Formula: C25H28O6 MolecularWeight: 424.48622

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(COC1=CC=C(C=C1)C(=O)O)C2=CC3=C(O2)C=CC(=C3)C(C)(C)C

Isomeric SMILES

CCCC(=O)OC(COC1=CC=C(C=C1)C(=O)O)C2=CC3=C(O2)C=CC(=C3)C(C)(C)C

InChI

InChI=1S/C25H28O6/c1-5-6-23(26)31-22(15-29-19-10-7-16(8-11-19)24(27)28)21-14-17-13-18(25(2,3)4)9-12-20(17)30-21/h7-14,22H,5-6,15H2,1-4H3,(H,27,28)