2-[5-[2-bromanyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]propanoic acid

Systemtic Name: 2-[5-[2-bromanyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]propanoic acid Openeye Name: 2-[5-[2-bromo-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]propanoic acid CAS Name: 2-[5-[2-bromo-4-(trifluoromethyl)phenoxy]-2-nitrophenoxy]propanoic acid IUPAC Name: 2-[5-[2-bromo-4-(trifluoromethyl)phenoxy]-2-nitrophenoxy]propanoic acid Traditional Name: 2-[5-[2-bromo-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]propionic acid Formula: C16H11BrF3NO6 MolecularWeight: 450.16085

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Br)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)O)OC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H11BrF3NO6/c1-8(15(22)23)26-14-7-10(3-4-12(14)21(24)25)27-13-5-2-9(6-11(13)17)16(18,19)20/h2-8H,1H3,(H,22,23)