2-[2-fluoranyl-5-[4-[[[2-methyl-3-(methylsulfonylamino)phenyl]-(phenylmethyl)amino]methyl]phenoxy]phenoxy]ethanoic acid

Systemtic Name: 2-[2-fluoranyl-5-[4-[[[2-methyl-3-(methylsulfonylamino)phenyl]-(phenylmethyl)amino]methyl]phenoxy]phenoxy]ethanoic acid Openeye Name: 2-[5-[4-[[N-benzyl-3-(methanesulfonamido)-2-methyl-anilino]methyl]phenoxy]-2-fluoro-phenoxy]acetic acid CAS Name: 2-[2-fluoro-5-[4-[[3-(methanesulfonamido)-2-methyl-N-(phenylmethyl)anilino]methyl]phenoxy]phenoxy]acetic acid IUPAC Name: 2-[5-[4-[[N-benzyl-3-(methanesulfonamido)-2-methylanilino]methyl]phenoxy]-2-fluorophenoxy]acetic acid Traditional Name: 2-[5-[4-[[N-benzyl-3-(methanesulfonamido)-2-methyl-anilino]methyl]phenoxy]-2-fluoro-phenoxy]acetic acid Formula: C30H29FN2O6S MolecularWeight: 564.624463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N(CC2=CC=CC=C2)CC3=CC=C(C=C3)OC4=CC(=C(C=C4)F)OCC(=O)O)NS(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC=C1N(CC2=CC=CC=C2)CC3=CC=C(C=C3)OC4=CC(=C(C=C4)F)OCC(=O)O)NS(=O)(=O)C

InChI

InChI=1S/C30H29FN2O6S/c1-21-27(32-40(2,36)37)9-6-10-28(21)33(18-22-7-4-3-5-8-22)19-23-11-13-24(14-12-23)39-25-15-16-26(31)29(17-25)38-20-30(34)35/h3-17,32H,18-20H2,1-2H3,(H,34,35)