2-ethylhexyl 3-sulfooxypropanoate

Systemtic Name: 2-ethylhexyl 3-sulfooxypropanoate Openeye Name: 2-ethylhexyl 3-sulfooxypropanoate CAS Name: 3-sulfooxypropanoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 3-sulfooxypropanoate Traditional Name: 3-sulfoxypropionic acid 2-ethylhexyl ester Formula: C11H22O6S MolecularWeight: 282.35378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)CCOS(=O)(=O)O

Isomeric SMILES

CCCCC(CC)COC(=O)CCOS(=O)(=O)O

InChI

InChI=1S/C11H22O6S/c1-3-5-6-10(4-2)9-16-11(12)7-8-17-18(13,14)15/h10H,3-9H2,1-2H3,(H,13,14,15)