sodium 2-[2-bromanyl-5-[2-chloranyl-4-(trifluoromethyl)phenoxy]phenoxy]butanoate

Systemtic Name: sodium 2-[2-bromanyl-5-[2-chloranyl-4-(trifluoromethyl)phenoxy]phenoxy]butanoate Openeye Name: sodium 2-[2-bromo-5-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]butanoate CAS Name: sodium 2-[2-bromo-5-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]butanoate IUPAC Name: sodium 2-[2-bromo-5-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]butanoate Traditional Name: sodium 2-[2-bromo-5-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]butyrate Formula: C17H12BrClF3NaO4 MolecularWeight: 475.61676

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])OC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)Br.[Na+]

Isomeric SMILES

CCC(C(=O)[O-])OC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)Br.[Na+]

InChI

InChI=1S/C17H13BrClF3O4.Na/c1-2-13(16(23)24)26-15-8-10(4-5-11(15)18)25-14-6-3-9(7-12(14)19)17(20,21)22;/h3-8,13H,2H2,1H3,(H,23,24);/q;+1/p-1