3-(4-methylpiperidin-1-ium-1-yl)propyl-[(3S)-thiolan-3-yl]azanium

Systemtic Name: 3-(4-methylpiperidin-1-ium-1-yl)propyl-[(3S)-thiolan-3-yl]azanium Openeye Name: 3-(4-methylpiperidin-1-ium-1-yl)propyl-[(3S)-tetrahydrothiophen-3-yl]ammonium CAS Name: 3-(4-methyl-1-piperidin-1-iumyl)propyl-[(3S)-3-thiolanyl]ammonium IUPAC Name: 3-(4-methylpiperidin-1-ium-1-yl)propyl-[(3S)-thiolan-3-yl]azanium Traditional Name: 3-(4-methylpiperidin-1-ium-1-yl)propyl-[(3S)-tetrahydrothiophen-3-yl]ammonium Formula: C13H28N2S+2 MolecularWeight: 244.43982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCC[NH2+]C2CCSC2

Isomeric SMILES

CC1CC[NH+](CC1)CCC[NH2+][C@H]2CCSC2

InChI

InChI=1S/C13H26N2S/c1-12-3-8-15(9-4-12)7-2-6-14-13-5-10-16-11-13/h12-14H,2-11H2,1H3/p+2/t13-/m0/s1