(7S)-5-(4-methylphenyl)sulfonyl-7-oxidanyl-octan-4-one

Systemtic Name: (7S)-5-(4-methylphenyl)sulfonyl-7-oxidanyl-octan-4-one Openeye Name: (7S)-7-hydroxy-5-(p-tolylsulfonyl)octan-4-one CAS Name: (7S)-7-hydroxy-5-(4-methylphenyl)sulfonyl-4-octanone IUPAC Name: (7S)-7-hydroxy-5-(4-methylphenyl)sulfonyloctan-4-one Traditional Name: (7S)-7-hydroxy-5-tosyl-octan-4-one Formula: C15H22O4S MolecularWeight: 298.39778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(CC(C)O)S(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCC(=O)C(C[C@H](C)O)S(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C15H22O4S/c1-4-5-14(17)15(10-12(3)16)20(18,19)13-8-6-11(2)7-9-13/h6-9,12,15-16H,4-5,10H2,1-3H3/t12-,15?/m0/s1