[2-methoxy-3-[[2-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenoxy]-oxidanyl-phosphanyl]oxy-propyl] N-hexadecylcarbamate

Systemtic Name: [2-methoxy-3-[[2-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenoxy]-oxidanyl-phosphanyl]oxy-propyl] N-hexadecylcarbamate Openeye Name: [3-[hydroxy-[2-[(5-methylthiazol-3-ium-3-yl)methyl]phenoxy]phosphanyl]oxy-2-methoxy-propyl] N-hexadecylcarbamate CAS Name: N-hexadecylcarbamic acid [3-[hydroxy-[2-[(5-methyl-3-thiazol-3-iumyl)methyl]phenoxy]phosphino]oxy-2-methoxypropyl] ester IUPAC Name: [3-[hydroxy-[2-[(5-methyl-1,3-thiazol-3-ium-3-yl)methyl]phenoxy]phosphanyl]oxy-2-methoxypropyl] N-hexadecylcarbamate Traditional Name: N-cetylcarbamic acid [3-[hydroxy-[2-[(5-methylthiazol-3-ium-3-yl)methyl]phenoxy]phosphino]oxy-2-methoxy-propyl] ester Formula: C32H54N2O6PS+ MolecularWeight: 625.819721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)OCC(COP(O)OC1=CC=CC=C1C[N+]2=CSC(=C2)C)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=O)OCC(COP(O)OC1=CC=CC=C1C[N+]2=CSC(=C2)C)OC

InChI

InChI=1S/C32H53N2O6PS/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-33-32(35)38-25-30(37-3)26-39-41(36)40-31-21-18-17-20-29(31)24-34-23-28(2)42-27-34/h17-18,20-21,23,27,30,36H,4-16,19,22,24-26H2,1-3H3/p+1