[(2S,3R)-15-methyl-2,3-bis(oxidanyl)hexadecyl] 2,2-dimethylpropanoate

Systemtic Name: [(2S,3R)-15-methyl-2,3-bis(oxidanyl)hexadecyl] 2,2-dimethylpropanoate Openeye Name: [(2S,3R)-2,3-dihydroxy-15-methyl-hexadecyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(2S,3R)-2,3-dihydroxy-15-methylhexadecyl] ester IUPAC Name: [(2S,3R)-2,3-dihydroxy-15-methylhexadecyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(2S,3R)-2,3-dihydroxy-15-methyl-hexadecyl] ester Formula: C22H44O4 MolecularWeight: 372.58236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCC(C(COC(=O)C(C)(C)C)O)O

Isomeric SMILES

CC(C)CCCCCCCCCCC[C@H]([C@H](COC(=O)C(C)(C)C)O)O

InChI

InChI=1S/C22H44O4/c1-18(2)15-13-11-9-7-6-8-10-12-14-16-19(23)20(24)17-26-21(25)22(3,4)5/h18-20,23-24H,6-17H2,1-5H3/t19-,20+/m1/s1