2-[2-[3-azanyl-2-chloranyl-4-fluoranyl-5-[4,4,4-tris(fluoranyl)-3,3-bis(oxidanyl)butanoyl]phenoxy]phenoxy]ethanoate

Systemtic Name: 2-[2-[3-azanyl-2-chloranyl-4-fluoranyl-5-[4,4,4-tris(fluoranyl)-3,3-bis(oxidanyl)butanoyl]phenoxy]phenoxy]ethanoate Openeye Name: 2-[2-[3-amino-2-chloro-4-fluoro-5-(4,4,4-trifluoro-3,3-dihydroxy-butanoyl)phenoxy]phenoxy]acetate CAS Name: 2-[2-[3-amino-2-chloro-4-fluoro-5-(4,4,4-trifluoro-3,3-dihydroxy-1-oxobutyl)phenoxy]phenoxy]acetate IUPAC Name: 2-[2-[3-amino-2-chloro-4-fluoro-5-(4,4,4-trifluoro-3,3-dihydroxybutanoyl)phenoxy]phenoxy]acetate Traditional Name: 2-[2-[3-amino-2-chloro-4-fluoro-5-(4,4,4-trifluoro-3,3-dihydroxy-butanoyl)phenoxy]phenoxy]acetate Formula: C18H13ClF4NO7- MolecularWeight: 466.744933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCC(=O)[O-])OC2=C(C(=C(C(=C2)C(=O)CC(C(F)(F)F)(O)O)F)N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)OCC(=O)[O-])OC2=C(C(=C(C(=C2)C(=O)CC(C(F)(F)F)(O)O)F)N)Cl

InChI

InChI=1S/C18H14ClF4NO7/c19-14-12(31-11-4-2-1-3-10(11)30-7-13(26)27)5-8(15(20)16(14)24)9(25)6-17(28,29)18(21,22)23/h1-5,28-29H,6-7,24H2,(H,26,27)/p-1