7-[methylsulfonyl-[[4-(1-oxidanyl-3-phenyl-propyl)phenyl]methyl]amino]heptanoic acid

Systemtic Name: 7-[methylsulfonyl-[[4-(1-oxidanyl-3-phenyl-propyl)phenyl]methyl]amino]heptanoic acid Openeye Name: 7-[[4-(1-hydroxy-3-phenyl-propyl)phenyl]methyl-methylsulfonyl-amino]heptanoic acid CAS Name: 7-[[4-(1-hydroxy-3-phenylpropyl)phenyl]methyl-methylsulfonylamino]heptanoic acid IUPAC Name: 7-[[4-(1-hydroxy-3-phenylpropyl)phenyl]methyl-methylsulfonylamino]heptanoic acid Traditional Name: 7-[[4-(1-hydroxy-3-phenyl-propyl)benzyl]-mesyl-amino]enanthic acid Formula: C24H33NO5S MolecularWeight: 447.58752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCCCCC(=O)O)CC1=CC=C(C=C1)C(CCC2=CC=CC=C2)O

Isomeric SMILES

CS(=O)(=O)N(CCCCCCC(=O)O)CC1=CC=C(C=C1)C(CCC2=CC=CC=C2)O

InChI

InChI=1S/C24H33NO5S/c1-31(29,30)25(18-8-3-2-7-11-24(27)28)19-21-12-15-22(16-13-21)23(26)17-14-20-9-5-4-6-10-20/h4-6,9-10,12-13,15-16,23,26H,2-3,7-8,11,14,17-19H2,1H3,(H,27,28)