9-(2-hydroxyethylsulfonyl)-12-oxidanyl-heptadecanoic acid

Systemtic Name: 9-(2-hydroxyethylsulfonyl)-12-oxidanyl-heptadecanoic acid Openeye Name: 12-hydroxy-9-(2-hydroxyethylsulfonyl)heptadecanoic acid CAS Name: 12-hydroxy-9-(2-hydroxyethylsulfonyl)heptadecanoic acid IUPAC Name: 12-hydroxy-9-(2-hydroxyethylsulfonyl)heptadecanoic acid Traditional Name: 12-hydroxy-9-(2-hydroxyethylsulfonyl)heptadecanoic acid Formula: C19H38O6S MolecularWeight: 394.56642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCC(CCCCCCCC(=O)O)S(=O)(=O)CCO)O

Isomeric SMILES

CCCCCC(CCC(CCCCCCCC(=O)O)S(=O)(=O)CCO)O

InChI

InChI=1S/C19H38O6S/c1-2-3-7-10-17(21)13-14-18(26(24,25)16-15-20)11-8-5-4-6-9-12-19(22)23/h17-18,20-21H,2-16H2,1H3,(H,22,23)