methyl [5-(4-tetradecyloxolan-2-yl)-5-(1,3-thiazol-3-ium-3-yl)pentyl] carbonate

Systemtic Name: methyl [5-(4-tetradecyloxolan-2-yl)-5-(1,3-thiazol-3-ium-3-yl)pentyl] carbonate Openeye Name: methyl [5-(4-tetradecyltetrahydrofuran-2-yl)-5-thiazol-3-ium-3-yl-pentyl] carbonate CAS Name: carbonic acid methyl [5-(4-tetradecyl-2-oxolanyl)-5-(3-thiazol-3-iumyl)pentyl] ester IUPAC Name: methyl [5-(4-tetradecyloxolan-2-yl)-5-(1,3-thiazol-3-ium-3-yl)pentyl] carbonate Traditional Name: carbonic acid methyl [5-(4-myristyltetrahydrofuran-2-yl)-5-thiazol-3-ium-3-yl-pentyl] ester Formula: C28H50NO4S+ MolecularWeight: 496.7659

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1CC(OC1)C(CCCCOC(=O)OC)[N+]2=CSC=C2

Isomeric SMILES

CCCCCCCCCCCCCCC1CC(OC1)C(CCCCOC(=O)OC)[N+]2=CSC=C2

InChI

InChI=1S/C28H50NO4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-25-22-27(33-23-25)26(29-19-21-34-24-29)18-15-16-20-32-28(30)31-2/h19,21,24-27H,3-18,20,22-23H2,1-2H3/q+1