6-[[2-[3-(methylsulfonylamino)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]amino]-7-phenyl-heptanoic acid

Systemtic Name: 6-[[2-[3-(methylsulfonylamino)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]amino]-7-phenyl-heptanoic acid Openeye Name: 6-[[2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]-7-phenyl-heptanoic acid CAS Name: 6-[[2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]-7-phenylheptanoic acid IUPAC Name: 6-[[2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]-7-phenylheptanoic acid Traditional Name: 6-[[2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]-7-phenyl-enanthic acid Formula: C22H30N2O6S MolecularWeight: 450.5484

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(C=CC(=C1)C(CNC(CCCCC(=O)O)CC2=CC=CC=C2)O)O

Isomeric SMILES

CS(=O)(=O)NC1=C(C=CC(=C1)C(CNC(CCCCC(=O)O)CC2=CC=CC=C2)O)O

InChI

InChI=1S/C22H30N2O6S/c1-31(29,30)24-19-14-17(11-12-20(19)25)21(26)15-23-18(9-5-6-10-22(27)28)13-16-7-3-2-4-8-16/h2-4,7-8,11-12,14,18,21,23-26H,5-6,9-10,13,15H2,1H3,(H,27,28)