1-oxidanylhexyl 2-(hydroxymethyl)-2-methyl-3-oxidanyl-propanoate

Systemtic Name: 1-oxidanylhexyl 2-(hydroxymethyl)-2-methyl-3-oxidanyl-propanoate Openeye Name: 1-hydroxyhexyl 3-hydroxy-2-(hydroxymethyl)-2-methyl-propanoate CAS Name: 3-hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid 1-hydroxyhexyl ester IUPAC Name: 1-hydroxyhexyl 3-hydroxy-2-(hydroxymethyl)-2-methylpropanoate Traditional Name: 3-hydroxy-2-methyl-2-methylol-propionic acid 1-hydroxyhexyl ester Formula: C11H22O5 MolecularWeight: 234.28938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(O)OC(=O)C(C)(CO)CO

Isomeric SMILES

CCCCCC(O)OC(=O)C(C)(CO)CO

InChI

InChI=1S/C11H22O5/c1-3-4-5-6-9(14)16-10(15)11(2,7-12)8-13/h9,12-14H,3-8H2,1-2H3