(2-butyl-1-benzofuran-3-yl)-[4-(2-diethylaminoethyl)-3,5-bis(iodanyl)phenyl]methanone

Systemtic Name: (2-butyl-1-benzofuran-3-yl)-[4-(2-diethylaminoethyl)-3,5-bis(iodanyl)phenyl]methanone Openeye Name: (2-butylbenzofuran-3-yl)-[4-(2-diethylaminoethyl)-3,5-diiodo-phenyl]methanone CAS Name: (2-butyl-3-benzofuranyl)-[4-(2-diethylaminoethyl)-3,5-diiodophenyl]methanone IUPAC Name: (2-butyl-1-benzofuran-3-yl)-[4-(2-diethylaminoethyl)-3,5-diiodophenyl]methanone Traditional Name: (2-butylbenzofuran-3-yl)-[4-(2-diethylaminoethyl)-3,5-diiodo-phenyl]methanone Formula: C25H29I2NO2 MolecularWeight: 629.3122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)CCN(CC)CC)I

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)CCN(CC)CC)I

InChI

InChI=1S/C25H29I2NO2/c1-4-7-11-23-24(19-10-8-9-12-22(19)30-23)25(29)17-15-20(26)18(21(27)16-17)13-14-28(5-2)6-3/h8-10,12,15-16H,4-7,11,13-14H2,1-3H3