13-(5-iodanylthiophen-2-yl)tridecanoic acid

Systemtic Name: 13-(5-iodanylthiophen-2-yl)tridecanoic acid Openeye Name: 13-(5-iodanyl-2-thienyl)tridecanoic acid CAS Name: 13-(5-iodanyl-2-thiophenyl)tridecanoic acid IUPAC Name: 13-(5-iodanylthiophen-2-yl)tridecanoic acid Traditional Name: 13-(5-iodanyl-2-thienyl)tridecanoic acid Formula: C17H27IO2S MolecularWeight: 420.364704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)I)CCCCCCCCCCCCC(=O)O

Isomeric SMILES

C1=C(SC(=C1)[125I])CCCCCCCCCCCCC(=O)O

InChI

InChI=1S/C17H27IO2S/c18-16-14-13-15(21-16)11-9-7-5-3-1-2-4-6-8-10-12-17(19)20/h13-14H,1-12H2,(H,19,20)/i18-2