1-(2-butyl-1-benzofuran-3-yl)-2-(3-iodanyl-4-methoxy-phenyl)ethanone

Systemtic Name: 1-(2-butyl-1-benzofuran-3-yl)-2-(3-iodanyl-4-methoxy-phenyl)ethanone Openeye Name: 1-(2-butylbenzofuran-3-yl)-2-(3-iodo-4-methoxy-phenyl)ethanone CAS Name: 1-(2-butyl-3-benzofuranyl)-2-(3-iodo-4-methoxyphenyl)ethanone IUPAC Name: 1-(2-butyl-1-benzofuran-3-yl)-2-(3-iodo-4-methoxyphenyl)ethanone Traditional Name: 1-(2-butylbenzofuran-3-yl)-2-(3-iodo-4-methoxy-phenyl)ethanone Formula: C21H21IO3 MolecularWeight: 448.29411

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21IO3/c1-3-4-8-20-21(15-7-5-6-9-18(15)25-20)17(23)13-14-10-11-19(24-2)16(22)12-14/h5-7,9-12H,3-4,8,13H2,1-2H3