2,4,6-trinitro-3-(2,4,6-trinitro-3-oxidanyl-phenyl)phenol

Systemtic Name: 2,4,6-trinitro-3-(2,4,6-trinitro-3-oxidanyl-phenyl)phenol Openeye Name: 3-(3-hydroxy-2,4,6-trinitro-phenyl)-2,4,6-trinitro-phenol CAS Name: 3-(3-hydroxy-2,4,6-trinitrophenyl)-2,4,6-trinitrophenol IUPAC Name: 3-(3-hydroxy-2,4,6-trinitrophenyl)-2,4,6-trinitrophenol Traditional Name: 3-(3-hydroxy-2,4,6-trinitro-phenyl)-2,4,6-trinitro-phenol Formula: C12H4N6O14 MolecularWeight: 456.19196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H4N6O14/c19-11-5(15(25)26)1-3(13(21)22)7(9(11)17(29)30)8-4(14(23)24)2-6(16(27)28)12(20)10(8)18(31)32/h1-2,19-20H