4-[(4-azanyl-3,5-dinitro-phenyl)methyl]-2,6-dinitro-aniline

Systemtic Name: 4-[(4-azanyl-3,5-dinitro-phenyl)methyl]-2,6-dinitro-aniline Openeye Name: 4-[(4-amino-3,5-dinitro-phenyl)methyl]-2,6-dinitro-aniline CAS Name: 4-[(4-amino-3,5-dinitrophenyl)methyl]-2,6-dinitroaniline IUPAC Name: 4-[(4-amino-3,5-dinitrophenyl)methyl]-2,6-dinitroaniline Traditional Name: [4-(4-amino-3,5-dinitro-benzyl)-2,6-dinitro-phenyl]amine Formula: C13H10N6O8 MolecularWeight: 378.2539

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])CC2=CC(=C(C(=C2)[N+](=O)[O-])N)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])CC2=CC(=C(C(=C2)[N+](=O)[O-])N)[N+](=O)[O-]

InChI

InChI=1S/C13H10N6O8/c14-12-8(16(20)21)2-6(3-9(12)17(22)23)1-7-4-10(18(24)25)13(15)11(5-7)19(26)27/h2-5H,1,14-15H2