3-hexyl-2-(1-methylpyridin-1-ium-3-yl)-1,3-thiazolidin-4-one

Systemtic Name: 3-hexyl-2-(1-methylpyridin-1-ium-3-yl)-1,3-thiazolidin-4-one Openeye Name: 3-hexyl-2-(1-methylpyridin-1-ium-3-yl)thiazolidin-4-one CAS Name: 3-hexyl-2-(1-methyl-3-pyridin-1-iumyl)-4-thiazolidinone IUPAC Name: 3-hexyl-2-(1-methylpyridin-1-ium-3-yl)-1,3-thiazolidin-4-one Traditional Name: 3-hexyl-2-(1-methylpyridin-1-ium-3-yl)thiazolidin-4-one Formula: C15H23N2OS+ MolecularWeight: 279.42092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(SCC1=O)C2=C[N+](=CC=C2)C

Isomeric SMILES

CCCCCCN1C(SCC1=O)C2=C[N+](=CC=C2)C

InChI

InChI=1S/C15H23N2OS/c1-3-4-5-6-10-17-14(18)12-19-15(17)13-8-7-9-16(2)11-13/h7-9,11,15H,3-6,10,12H2,1-2H3/q+1