5-[2-chloranyl-5-(trifluoromethyl)phenoxy]-2-nitro-phenolate

Systemtic Name: 5-[2-chloranyl-5-(trifluoromethyl)phenoxy]-2-nitro-phenolate Openeye Name: 5-[2-chloro-5-(trifluoromethyl)phenoxy]-2-nitro-phenolate CAS Name: 5-[2-chloro-5-(trifluoromethyl)phenoxy]-2-nitrophenolate IUPAC Name: 5-[2-chloro-5-(trifluoromethyl)phenoxy]-2-nitrophenolate Traditional Name: 5-[2-chloro-5-(trifluoromethyl)phenoxy]-2-nitro-phenolate Formula: C13H6ClF3NO4- MolecularWeight: 332.63925

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)OC2=CC(=C(C=C2)[N+](=O)[O-])[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)OC2=CC(=C(C=C2)[N+](=O)[O-])[O-])Cl

InChI

InChI=1S/C13H7ClF3NO4/c14-9-3-1-7(13(15,16)17)5-12(9)22-8-2-4-10(18(20)21)11(19)6-8/h1-6,19H/p-1