2-(5-iodanyl-4-octyl-thiophen-2-yl)-5,5-dimethyl-1,3,2-dioxaborinane

Systemtic Name: 2-(5-iodanyl-4-octyl-thiophen-2-yl)-5,5-dimethyl-1,3,2-dioxaborinane Openeye Name: 2-(5-iodo-4-octyl-2-thienyl)-5,5-dimethyl-1,3,2-dioxaborinane CAS Name: 2-(5-iodo-4-octyl-2-thiophenyl)-5,5-dimethyl-1,3,2-dioxaborinane IUPAC Name: 2-(5-iodo-4-octylthiophen-2-yl)-5,5-dimethyl-1,3,2-dioxaborinane Traditional Name: 2-(5-iodo-4-octyl-2-thienyl)-5,5-dimethyl-1,3,2-dioxaborinane Formula: C17H28BIO2S MolecularWeight: 434.18349

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B1(OCC(CO1)(C)C)C2=CC(=C(S2)I)CCCCCCCC

Isomeric SMILES

B1(OCC(CO1)(C)C)C2=CC(=C(S2)I)CCCCCCCC

InChI

InChI=1S/C17H28BIO2S/c1-4-5-6-7-8-9-10-14-11-15(22-16(14)19)18-20-12-17(2,3)13-21-18/h11H,4-10,12-13H2,1-3H3