3-[(5-azanyl-2-nitro-phenoxy)methoxy]-4-nitro-aniline

Systemtic Name: 3-[(5-azanyl-2-nitro-phenoxy)methoxy]-4-nitro-aniline Openeye Name: 3-[(5-amino-2-nitro-phenoxy)methoxy]-4-nitro-aniline CAS Name: 3-[(5-amino-2-nitrophenoxy)methoxy]-4-nitroaniline IUPAC Name: 3-[(5-amino-2-nitrophenoxy)methoxy]-4-nitroaniline Traditional Name: [3-[(5-amino-2-nitro-phenoxy)methoxy]-4-nitro-phenyl]amine Formula: C13H12N4O6 MolecularWeight: 320.25758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)OCOC2=C(C=CC(=C2)N)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1N)OCOC2=C(C=CC(=C2)N)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O6/c14-8-1-3-10(16(18)19)12(5-8)22-7-23-13-6-9(15)2-4-11(13)17(20)21/h1-6H,7,14-15H2