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

Systemtic Name: 2-nitro-4-[2,2,2-tris(chloranyl)-1-(3-nitro-4-oxidanyl-phenyl)ethyl]phenol Openeye Name: 2-nitro-4-[2,2,2-trichloro-1-(4-hydroxy-3-nitro-phenyl)ethyl]phenol CAS Name: 2-nitro-4-[2,2,2-trichloro-1-(4-hydroxy-3-nitrophenyl)ethyl]phenol IUPAC Name: 2-nitro-4-[2,2,2-trichloro-1-(4-hydroxy-3-nitrophenyl)ethyl]phenol Traditional Name: 2-nitro-4-[2,2,2-trichloro-1-(4-hydroxy-3-nitro-phenyl)ethyl]phenol Formula: C14H9Cl3N2O6 MolecularWeight: 407.59006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9Cl3N2O6/c15-14(16,17)13(7-1-3-11(20)9(5-7)18(22)23)8-2-4-12(21)10(6-8)19(24)25/h1-6,13,20-21H