3-methyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)quinoline

Systemtic Name: 3-methyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)quinoline Openeye Name: 3-methyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)quinoline CAS Name: 3-methyl-2-[2-(1-piperidin-1-iumyl)ethylthio]quinoline IUPAC Name: 3-methyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)quinoline Traditional Name: 3-methyl-2-(2-piperidin-1-ium-1-ylethylthio)quinoline Formula: C17H23N2S+ MolecularWeight: 287.44292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2N=C1SCC[NH+]3CCCCC3

Isomeric SMILES

CC1=CC2=CC=CC=C2N=C1SCC[NH+]3CCCCC3

InChI

InChI=1S/C17H22N2S/c1-14-13-15-7-3-4-8-16(15)18-17(14)20-12-11-19-9-5-2-6-10-19/h3-4,7-8,13H,2,5-6,9-12H2,1H3/p+1