4-[5-[4-[[[2,4-bis(fluoranyl)phenyl]methyl-[2-methyl-3-(methylsulfonylamino)phenyl]amino]methyl]phenoxy]-2-chloranyl-phenoxy]butanoic acid

Systemtic Name: 4-[5-[4-[[[2,4-bis(fluoranyl)phenyl]methyl-[2-methyl-3-(methylsulfonylamino)phenyl]amino]methyl]phenoxy]-2-chloranyl-phenoxy]butanoic acid Openeye Name: 4-[2-chloro-5-[4-[[N-[(2,4-difluorophenyl)methyl]-3-(methanesulfonamido)-2-methyl-anilino]methyl]phenoxy]phenoxy]butanoic acid CAS Name: 4-[2-chloro-5-[4-[[N-[(2,4-difluorophenyl)methyl]-3-(methanesulfonamido)-2-methylanilino]methyl]phenoxy]phenoxy]butanoic acid IUPAC Name: 4-[2-chloro-5-[4-[[N-[(2,4-difluorophenyl)methyl]-3-(methanesulfonamido)-2-methylanilino]methyl]phenoxy]phenoxy]butanoic acid Traditional Name: 4-[2-chloro-5-[4-[[N-(2,4-difluorobenzyl)-3-(methanesulfonamido)-2-methyl-anilino]methyl]phenoxy]phenoxy]butyric acid Formula: C32H31ClF2N2O6S MolecularWeight: 645.113146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N(CC2=CC=C(C=C2)OC3=CC(=C(C=C3)Cl)OCCCC(=O)O)CC4=C(C=C(C=C4)F)F)NS(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC=C1N(CC2=CC=C(C=C2)OC3=CC(=C(C=C3)Cl)OCCCC(=O)O)CC4=C(C=C(C=C4)F)F)NS(=O)(=O)C

InChI

InChI=1S/C32H31ClF2N2O6S/c1-21-29(36-44(2,40)41)5-3-6-30(21)37(20-23-10-11-24(34)17-28(23)35)19-22-8-12-25(13-9-22)43-26-14-15-27(33)31(18-26)42-16-4-7-32(38)39/h3,5-6,8-15,17-18,36H,4,7,16,19-20H2,1-2H3,(H,38,39)