4-[[2-[[(2R)-3-fluoranyl-2-methyl-propyl]-pyridin-2-ylsulfonyl-amino]-4,5-dimethyl-phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[2-[[(2R)-3-fluoranyl-2-methyl-propyl]-pyridin-2-ylsulfonyl-amino]-4,5-dimethyl-phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-[[(2R)-3-fluoro-2-methyl-propyl]-(2-pyridylsulfonyl)amino]-4,5-dimethyl-phenoxy]methyl]benzoic acid CAS Name: 4-[[2-[[(2R)-3-fluoro-2-methylpropyl]-(2-pyridinylsulfonyl)amino]-4,5-dimethylphenoxy]methyl]benzoic acid IUPAC Name: 4-[[2-[[(2R)-3-fluoro-2-methylpropyl]-pyridin-2-ylsulfonylamino]-4,5-dimethylphenoxy]methyl]benzoic acid Traditional Name: 4-[[2-[[(2R)-3-fluoro-2-methyl-propyl]-(2-pyridylsulfonyl)amino]-4,5-dimethyl-phenoxy]methyl]benzoic acid Formula: C25H27FN2O5S MolecularWeight: 486.555683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)OCC2=CC=C(C=C2)C(=O)O)N(CC(C)CF)S(=O)(=O)C3=CC=CC=N3

Isomeric SMILES

CC1=CC(=C(C=C1C)OCC2=CC=C(C=C2)C(=O)O)N(C[C@@H](C)CF)S(=O)(=O)C3=CC=CC=N3

InChI

InChI=1S/C25H27FN2O5S/c1-17(14-26)15-28(34(31,32)24-6-4-5-11-27-24)22-12-18(2)19(3)13-23(22)33-16-20-7-9-21(10-8-20)25(29)30/h4-13,17H,14-16H2,1-3H3,(H,29,30)/t17-/m0/s1