[5-[2-cyano-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]phosphonic acid

Systemtic Name: [5-[2-cyano-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]phosphonic acid Openeye Name: [5-[2-cyano-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]phosphonic acid CAS Name: [5-[2-cyano-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]phosphonic acid IUPAC Name: [5-[2-cyano-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]phosphonic acid Traditional Name: [5-[2-cyano-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]phosphonic acid Formula: C14H8F3N2O6P MolecularWeight: 388.192091

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H8F3N2O6P/c15-14(16,17)9-1-4-12(8(5-9)7-18)25-10-2-3-11(19(20)21)13(6-10)26(22,23)24/h1-6H,(H2,22,23,24)