1-[2,2-dimethyl-1-[methyl(octadecyl)carbamoyl]oxy-3-sulfinyl-propoxy]heptan-3-yl methanesulfonate

Systemtic Name: 1-[2,2-dimethyl-1-[methyl(octadecyl)carbamoyl]oxy-3-sulfinyl-propoxy]heptan-3-yl methanesulfonate Openeye Name: 1-[2-[2,2-dimethyl-1-[methyl(octadecyl)carbamoyl]oxy-3-sulfinyl-propoxy]ethyl]pentyl methanesulfonate CAS Name: methanesulfonic acid 1-[2,2-dimethyl-1-[[methyl(octadecyl)amino]-oxomethoxy]-3-sulfinylpropoxy]heptan-3-yl ester IUPAC Name: 1-[2,2-dimethyl-1-[methyl(octadecyl)carbamoyl]oxy-3-sulfinylpropoxy]heptan-3-yl methanesulfonate Traditional Name: methanesulfonic acid 1-[2-[2,2-dimethyl-1-[methyl(stearyl)carbamoyl]oxy-3-sulfinyl-propoxy]ethyl]pentyl ester Formula: C33H65NO7S2 MolecularWeight: 652.0017

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C)C(=O)OC(C(C)(C)C=S=O)OCCC(CCCC)OS(=O)(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C)C(=O)OC(C(C)(C)C=S=O)OCCC(CCCC)OS(=O)(=O)C

InChI

InChI=1S/C33H65NO7S2/c1-7-9-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-34(5)32(35)40-31(33(3,4)29-42-36)39-28-26-30(25-10-8-2)41-43(6,37)38/h29-31H,7-28H2,1-6H3