nonyl 2-sulfooxyhexanoate

Systemtic Name: nonyl 2-sulfooxyhexanoate Openeye Name: nonyl 2-sulfooxyhexanoate CAS Name: 2-sulfooxyhexanoic acid nonyl ester IUPAC Name: nonyl 2-sulfooxyhexanoate Traditional Name: 2-sulfoxyhexanoic acid nonyl ester Formula: C15H30O6S MolecularWeight: 338.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC(=O)C(CCCC)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCOC(=O)C(CCCC)OS(=O)(=O)O

InChI

InChI=1S/C15H30O6S/c1-3-5-7-8-9-10-11-13-20-15(16)14(12-6-4-2)21-22(17,18)19/h14H,3-13H2,1-2H3,(H,17,18,19)