2-[2,2-bis(methylsulfanyl)ethenyl]-6-methoxy-1-methyl-quinolin-1-ium iodide

Systemtic Name: 2-[2,2-bis(methylsulfanyl)ethenyl]-6-methoxy-1-methyl-quinolin-1-ium iodide Openeye Name: 2-[2,2-bis(methylsulfanyl)vinyl]-6-methoxy-1-methyl-quinolin-1-ium iodide CAS Name: 2-[2,2-bis(methylthio)ethenyl]-6-methoxy-1-methylquinolin-1-ium iodide IUPAC Name: 2-[2,2-bis(methylsulfanyl)ethenyl]-6-methoxy-1-methylquinolin-1-ium iodide Traditional Name: 2-[2,2-bis(methylthio)vinyl]-6-methoxy-1-methyl-quinolin-1-ium iodide Formula: C15H18INOS2 MolecularWeight: 419.34399

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=CC2=C1C=CC(=C2)OC)C=C(SC)SC.[I-]

Isomeric SMILES

C[N+]1=C(C=CC2=C1C=CC(=C2)OC)C=C(SC)SC.[I-]

InChI

InChI=1S/C15H18NOS2.HI/c1-16-12(10-15(18-3)19-4)6-5-11-9-13(17-2)7-8-14(11)16;/h5-10H,1-4H3;1H/q+1;/p-1