1-dodecoxydodecane; 4-oxidanylidene-4-sulfooxy-butanoate

Systemtic Name: 1-dodecoxydodecane; 4-oxidanylidene-4-sulfooxy-butanoate Openeye Name: 1-dodecoxydodecane; 4-oxo-4-sulfooxy-butanoate CAS Name: 1-dodecoxydodecane; 4-oxo-4-sulfooxybutanoate IUPAC Name: 1-dodecoxydodecane; 4-oxo-4-sulfooxybutanoate Traditional Name: 4-keto-4-sulfoxy-butyrate; 1-lauryloxydodecane Formula: C28H55O8S- MolecularWeight: 551.7965

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCCCCCCCCCCCC.C(CC(=O)OS(=O)(=O)O)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCOCCCCCCCCCCCC.C(CC(=O)OS(=O)(=O)O)C(=O)[O-]

InChI

InChI=1S/C24H50O.C4H6O7S/c1-3-5-7-9-11-13-15-17-19-21-23-25-24-22-20-18-16-14-12-10-8-6-4-2;5-3(6)1-2-4(7)11-12(8,9)10/h3-24H2,1-2H3;1-2H2,(H,5,6)(H,8,9,10)/p-1