3-[1-(2-heptadecyl-1,3-dioxolan-4-yl)-5-methoxy-pentyl]-1,3-thiazol-3-ium

Systemtic Name: 3-[1-(2-heptadecyl-1,3-dioxolan-4-yl)-5-methoxy-pentyl]-1,3-thiazol-3-ium Openeye Name: 3-[1-(2-heptadecyl-1,3-dioxolan-4-yl)-5-methoxy-pentyl]thiazol-3-ium CAS Name: 3-[1-(2-heptadecyl-1,3-dioxolan-4-yl)-5-methoxypentyl]thiazol-3-ium IUPAC Name: 3-[1-(2-heptadecyl-1,3-dioxolan-4-yl)-5-methoxypentyl]-1,3-thiazol-3-ium Traditional Name: 3-[1-(2-heptadecyl-1,3-dioxolan-4-yl)-5-methoxy-pentyl]thiazol-3-ium Formula: C29H54NO3S+ MolecularWeight: 496.80896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1OCC(O1)C(CCCCOC)[N+]2=CSC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1OCC(O1)C(CCCCOC)[N+]2=CSC=C2

InChI

InChI=1S/C29H54NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-29-32-25-28(33-29)27(20-18-19-23-31-2)30-22-24-34-26-30/h22,24,26-29H,3-21,23,25H2,1-2H3/q+1