2-nitro-4-[2,2,2-tris(fluoranyl)-1-(3-nitro-4-oxidanyl-phenyl)-1-phenyl-ethyl]phenol

Systemtic Name: 2-nitro-4-[2,2,2-tris(fluoranyl)-1-(3-nitro-4-oxidanyl-phenyl)-1-phenyl-ethyl]phenol Openeye Name: 2-nitro-4-[2,2,2-trifluoro-1-(4-hydroxy-3-nitro-phenyl)-1-phenyl-ethyl]phenol CAS Name: 2-nitro-4-[2,2,2-trifluoro-1-(4-hydroxy-3-nitrophenyl)-1-phenylethyl]phenol IUPAC Name: 2-nitro-4-[2,2,2-trifluoro-1-(4-hydroxy-3-nitrophenyl)-1-phenylethyl]phenol Traditional Name: 2-nitro-4-[2,2,2-trifluoro-1-(4-hydroxy-3-nitro-phenyl)-1-phenyl-ethyl]phenol Formula: C20H13F3N2O6 MolecularWeight: 434.32223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC(=C(C=C2)O)[N+](=O)[O-])(C3=CC(=C(C=C3)O)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC(=C(C=C2)O)[N+](=O)[O-])(C3=CC(=C(C=C3)O)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C20H13F3N2O6/c21-20(22,23)19(12-4-2-1-3-5-12,13-6-8-17(26)15(10-13)24(28)29)14-7-9-18(27)16(11-14)25(30)31/h1-11,26-27H