methyl 8-methylsulfonyl-12-oxidanyl-heptadecanoate

Systemtic Name: methyl 8-methylsulfonyl-12-oxidanyl-heptadecanoate Openeye Name: methyl 12-hydroxy-8-methylsulfonyl-heptadecanoate CAS Name: 12-hydroxy-8-methylsulfonylheptadecanoic acid methyl ester IUPAC Name: methyl 12-hydroxy-8-methylsulfonylheptadecanoate Traditional Name: 12-hydroxy-8-mesyl-heptadecanoic acid methyl ester Formula: C19H38O5S MolecularWeight: 378.56702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CCCCCCC(=O)OC)S(=O)(=O)C)O

Isomeric SMILES

CCCCCC(CCCC(CCCCCCC(=O)OC)S(=O)(=O)C)O

InChI

InChI=1S/C19H38O5S/c1-4-5-8-12-17(20)13-11-15-18(25(3,22)23)14-9-6-7-10-16-19(21)24-2/h17-18,20H,4-16H2,1-3H3