hexadecyl 2-sulfooxyethanoate

Systemtic Name: hexadecyl 2-sulfooxyethanoate Openeye Name: hexadecyl 2-sulfooxyacetate CAS Name: 2-sulfooxyacetic acid hexadecyl ester IUPAC Name: hexadecyl 2-sulfooxyacetate Traditional Name: 2-sulfoxyacetic acid cetyl ester Formula: C18H36O6S MolecularWeight: 380.53984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)COS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)COS(=O)(=O)O

InChI

InChI=1S/C18H36O6S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-18(19)17-24-25(20,21)22/h2-17H2,1H3,(H,20,21,22)