sodium 5-[2-chloranyl-4-(trifluoromethyloxy)phenoxy]-2-nitro-benzoate

Systemtic Name: sodium 5-[2-chloranyl-4-(trifluoromethyloxy)phenoxy]-2-nitro-benzoate Openeye Name: sodium 5-[2-chloro-4-(trifluoromethoxy)phenoxy]-2-nitro-benzoate CAS Name: sodium 5-[2-chloro-4-(trifluoromethoxy)phenoxy]-2-nitrobenzoate IUPAC Name: sodium 5-[2-chloro-4-(trifluoromethoxy)phenoxy]-2-nitrobenzoate Traditional Name: sodium 5-[2-chloro-4-(trifluoromethoxy)phenoxy]-2-nitro-benzoate Formula: C14H6ClF3NNaO6 MolecularWeight: 399.63852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OC2=C(C=C(C=C2)OC(F)(F)F)Cl)C(=O)[O-])[N+](=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=C(C=C1OC2=C(C=C(C=C2)OC(F)(F)F)Cl)C(=O)[O-])[N+](=O)[O-].[Na+]

InChI

InChI=1S/C14H7ClF3NO6.Na/c15-10-6-8(25-14(16,17)18)2-4-12(10)24-7-1-3-11(19(22)23)9(5-7)13(20)21;/h1-6H,(H,20,21);/q;+1/p-1