ethyl 2-(1-hexadecylsulfanyl-3-oxidanyl-propan-2-yl)oxyethanoate; phosphoric acid

Systemtic Name: ethyl 2-(1-hexadecylsulfanyl-3-oxidanyl-propan-2-yl)oxyethanoate; phosphoric acid Openeye Name: ethyl 2-[1-(hexadecylsulfanylmethyl)-2-hydroxy-ethoxy]acetate; phosphoric acid CAS Name: 2-[1-(hexadecylthio)-3-hydroxypropan-2-yl]oxyacetic acid ethyl ester; phosphoric acid IUPAC Name: ethyl 2-(1-hexadecylsulfanyl-3-hydroxypropan-2-yl)oxyacetate; phosphoric acid Traditional Name: 2-[1-[(cetylthio)methyl]-2-hydroxy-ethoxy]acetic acid ethyl ester; phosphoric acid Formula: C23H49O8PS MolecularWeight: 516.669121

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC(CO)OCC(=O)OCC.OP(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCSCC(CO)OCC(=O)OCC.OP(=O)(O)O

InChI

InChI=1S/C23H46O4S.H3O4P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28-21-22(19-24)27-20-23(25)26-4-2;1-5(2,3)4/h22,24H,3-21H2,1-2H3;(H3,1,2,3,4)