4-isocyano-2-nitro-N-(3-nitrophenyl)aniline

Systemtic Name: 4-isocyano-2-nitro-N-(3-nitrophenyl)aniline Openeye Name: 4-isocyano-2-nitro-N-(3-nitrophenyl)aniline CAS Name: 4-isocyano-2-nitro-N-(3-nitrophenyl)aniline IUPAC Name: 4-isocyano-2-nitro-N-(3-nitrophenyl)aniline Traditional Name: (4-isocyano-2-nitro-phenyl)-(3-nitrophenyl)amine Formula: C13H8N4O4 MolecularWeight: 284.22702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC(=C(C=C1)NC2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

[C-]#[N+]C1=CC(=C(C=C1)NC2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H8N4O4/c1-14-9-5-6-12(13(8-9)17(20)21)15-10-3-2-4-11(7-10)16(18)19/h2-8,15H