2-[(1-methylpiperidin-3-yl)methylsulfanyl]-1-oxidanyl-pyridin-1-ium

Systemtic Name: 2-[(1-methylpiperidin-3-yl)methylsulfanyl]-1-oxidanyl-pyridin-1-ium Openeye Name: 1-hydroxy-2-[(1-methyl-3-piperidyl)methylsulfanyl]pyridin-1-ium CAS Name: 1-hydroxy-2-[(1-methyl-3-piperidinyl)methylthio]pyridin-1-ium IUPAC Name: 1-hydroxy-2-[(1-methylpiperidin-3-yl)methylsulfanyl]pyridin-1-ium Traditional Name: 1-hydroxy-2-[(1-methyl-3-piperidyl)methylthio]pyridin-1-ium Formula: C12H19N2OS+ MolecularWeight: 239.35706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)CSC2=CC=CC=[N+]2O

Isomeric SMILES

CN1CCCC(C1)CSC2=CC=CC=[N+]2O

InChI

InChI=1S/C12H19N2OS/c1-13-7-4-5-11(9-13)10-16-12-6-2-3-8-14(12)15/h2-3,6,8,11,15H,4-5,7,9-10H2,1H3/q+1