(3-dodecanoyloxy-2-sulfooxy-propyl) dodecanoate

Systemtic Name: (3-dodecanoyloxy-2-sulfooxy-propyl) dodecanoate Openeye Name: (3-dodecanoyloxy-2-sulfooxy-propyl) dodecanoate CAS Name: dodecanoic acid [3-(1-oxododecoxy)-2-sulfooxypropyl] ester IUPAC Name: (3-dodecanoyloxy-2-sulfooxypropyl) dodecanoate Traditional Name: lauric acid (3-lauroyloxy-2-sulfoxy-propyl) ester Formula: C27H52O8S MolecularWeight: 536.76198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC)OS(=O)(=O)O

InChI

InChI=1S/C27H52O8S/c1-3-5-7-9-11-13-15-17-19-21-26(28)33-23-25(35-36(30,31)32)24-34-27(29)22-20-18-16-14-12-10-8-6-4-2/h25H,3-24H2,1-2H3,(H,30,31,32)