methyl 6-oxidanyl-8-(phenylsulfonyl)octanoate

Systemtic Name: methyl 6-oxidanyl-8-(phenylsulfonyl)octanoate Openeye Name: methyl 8-(benzenesulfonyl)-6-hydroxy-octanoate CAS Name: 8-(benzenesulfonyl)-6-hydroxyoctanoic acid methyl ester IUPAC Name: methyl 8-(benzenesulfonyl)-6-hydroxyoctanoate Traditional Name: 8-besyl-6-hydroxy-caprylic acid methyl ester Formula: C15H22O5S MolecularWeight: 314.39718

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC(CCS(=O)(=O)C1=CC=CC=C1)O

Isomeric SMILES

COC(=O)CCCCC(CCS(=O)(=O)C1=CC=CC=C1)O

InChI

InChI=1S/C15H22O5S/c1-20-15(17)10-6-5-7-13(16)11-12-21(18,19)14-8-3-2-4-9-14/h2-4,8-9,13,16H,5-7,10-12H2,1H3