7-[methylsulfonyl-[[4-(1-oxidanyl-2-phenyl-ethyl)phenyl]methyl]amino]heptanoic acid

Systemtic Name: 7-[methylsulfonyl-[[4-(1-oxidanyl-2-phenyl-ethyl)phenyl]methyl]amino]heptanoic acid Openeye Name: 7-[[4-(1-hydroxy-2-phenyl-ethyl)phenyl]methyl-methylsulfonyl-amino]heptanoic acid CAS Name: 7-[[4-(1-hydroxy-2-phenylethyl)phenyl]methyl-methylsulfonylamino]heptanoic acid IUPAC Name: 7-[[4-(1-hydroxy-2-phenylethyl)phenyl]methyl-methylsulfonylamino]heptanoic acid Traditional Name: 7-[[4-(1-hydroxy-2-phenyl-ethyl)benzyl]-mesyl-amino]enanthic acid Formula: C23H31NO5S MolecularWeight: 433.56094

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCCCCC(=O)O)CC1=CC=C(C=C1)C(CC2=CC=CC=C2)O

Isomeric SMILES

CS(=O)(=O)N(CCCCCCC(=O)O)CC1=CC=C(C=C1)C(CC2=CC=CC=C2)O

InChI

InChI=1S/C23H31NO5S/c1-30(28,29)24(16-8-3-2-7-11-23(26)27)18-20-12-14-21(15-13-20)22(25)17-19-9-5-4-6-10-19/h4-6,9-10,12-15,22,25H,2-3,7-8,11,16-18H2,1H3,(H,26,27)