6-(2-azanyl-3,4,5-trinitro-phenyl)-2,3,4-trinitro-aniline

Systemtic Name: 6-(2-azanyl-3,4,5-trinitro-phenyl)-2,3,4-trinitro-aniline Openeye Name: 6-(2-amino-3,4,5-trinitro-phenyl)-2,3,4-trinitro-aniline CAS Name: 6-(2-amino-3,4,5-trinitrophenyl)-2,3,4-trinitroaniline IUPAC Name: 6-(2-amino-3,4,5-trinitrophenyl)-2,3,4-trinitroaniline Traditional Name: [6-(2-amino-3,4,5-trinitro-phenyl)-2,3,4-trinitro-phenyl]amine Formula: C12H6N8O12 MolecularWeight: 454.22244

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])N)C2=CC(=C(C(=C2N)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C(=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])N)C2=CC(=C(C(=C2N)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H6N8O12/c13-7-3(1-5(15(21)22)9(17(25)26)11(7)19(29)30)4-2-6(16(23)24)10(18(27)28)12(8(4)14)20(31)32/h1-2H,13-14H2