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

Systemtic Name: 2-[5-[4-[[[2,4-bis(fluoranyl)phenyl]methyl-(2-methyl-3-nitro-phenyl)amino]methyl]phenoxy]-2-chloranyl-phenoxy]ethanoic acid Openeye Name: 2-[2-chloro-5-[4-[[N-[(2,4-difluorophenyl)methyl]-2-methyl-3-nitro-anilino]methyl]phenoxy]phenoxy]acetic acid CAS Name: 2-[2-chloro-5-[4-[[N-[(2,4-difluorophenyl)methyl]-2-methyl-3-nitroanilino]methyl]phenoxy]phenoxy]acetic acid IUPAC Name: 2-[2-chloro-5-[4-[[N-[(2,4-difluorophenyl)methyl]-2-methyl-3-nitroanilino]methyl]phenoxy]phenoxy]acetic acid Traditional Name: 2-[2-chloro-5-[4-[(N-(2,4-difluorobenzyl)-2-methyl-3-nitro-anilino)methyl]phenoxy]phenoxy]acetic acid Formula: C29H23ClF2N2O6 MolecularWeight: 568.952526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])N(CC2=CC=C(C=C2)OC3=CC(=C(C=C3)Cl)OCC(=O)O)CC4=C(C=C(C=C4)F)F

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])N(CC2=CC=C(C=C2)OC3=CC(=C(C=C3)Cl)OCC(=O)O)CC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C29H23ClF2N2O6/c1-18-26(3-2-4-27(18)34(37)38)33(16-20-7-8-21(31)13-25(20)32)15-19-5-9-22(10-6-19)40-23-11-12-24(30)28(14-23)39-17-29(35)36/h2-14H,15-17H2,1H3,(H,35,36)