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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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