4-bromanyl-2-nitro-N-[(4-nitrophenyl)methyl]aniline

Systemtic Name: 4-bromanyl-2-nitro-N-[(4-nitrophenyl)methyl]aniline Openeye Name: 4-bromo-2-nitro-N-[(4-nitrophenyl)methyl]aniline CAS Name: 4-bromo-2-nitro-N-[(4-nitrophenyl)methyl]aniline IUPAC Name: 4-bromo-2-nitro-N-[(4-nitrophenyl)methyl]aniline Traditional Name: (4-bromo-2-nitro-phenyl)-(4-nitrobenzyl)amine Formula: C13H10BrN3O4 MolecularWeight: 352.1402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=C(C=C(C=C2)Br)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CNC2=C(C=C(C=C2)Br)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H10BrN3O4/c14-10-3-6-12(13(7-10)17(20)21)15-8-9-1-4-11(5-2-9)16(18)19/h1-7,15H,8H2