2-[5-[4-[[(3-azanyl-2-methyl-phenyl)-[(2-fluorophenyl)methyl]amino]methyl]phenoxy]-2-chloranyl-phenoxy]ethanoate

Systemtic Name: 2-[5-[4-[[(3-azanyl-2-methyl-phenyl)-[(2-fluorophenyl)methyl]amino]methyl]phenoxy]-2-chloranyl-phenoxy]ethanoate Openeye Name: 2-[5-[4-[[3-amino-N-[(2-fluorophenyl)methyl]-2-methyl-anilino]methyl]phenoxy]-2-chloro-phenoxy]acetate CAS Name: 2-[5-[4-[[3-amino-N-[(2-fluorophenyl)methyl]-2-methylanilino]methyl]phenoxy]-2-chlorophenoxy]acetate IUPAC Name: 2-[5-[4-[[3-amino-N-[(2-fluorophenyl)methyl]-2-methylanilino]methyl]phenoxy]-2-chlorophenoxy]acetate Traditional Name: 2-[5-[4-[(3-amino-N-(2-fluorobenzyl)-2-methyl-anilino)methyl]phenoxy]-2-chloro-phenoxy]acetate Formula: C29H25ClFN2O4- MolecularWeight: 519.971203

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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)OCC(=O)[O-])CC4=CC=CC=C4F)N

Isomeric SMILES

CC1=C(C=CC=C1N(CC2=CC=C(C=C2)OC3=CC(=C(C=C3)Cl)OCC(=O)[O-])CC4=CC=CC=C4F)N

InChI

InChI=1S/C29H26ClFN2O4/c1-19-26(32)7-4-8-27(19)33(17-21-5-2-3-6-25(21)31)16-20-9-11-22(12-10-20)37-23-13-14-24(30)28(15-23)36-18-29(34)35/h2-15H,16-18,32H2,1H3,(H,34,35)/p-1