8-[[2-(4-methoxyphenyl)-4-nitro-phenoxy]methyl]-6-nitro-4H-1,3-benzodioxine

Systemtic Name: 8-[[2-(4-methoxyphenyl)-4-nitro-phenoxy]methyl]-6-nitro-4H-1,3-benzodioxine Openeye Name: 8-[[2-(4-methoxyphenyl)-4-nitro-phenoxy]methyl]-6-nitro-4H-1,3-benzodioxine CAS Name: 8-[[2-(4-methoxyphenyl)-4-nitrophenoxy]methyl]-6-nitro-4H-1,3-benzodioxin IUPAC Name: 8-[[2-(4-methoxyphenyl)-4-nitrophenoxy]methyl]-6-nitro-4H-1,3-benzodioxine Traditional Name: 8-[[2-(4-methoxyphenyl)-4-nitro-phenoxy]methyl]-6-nitro-4H-1,3-benzodioxin Formula: C22H18N2O8 MolecularWeight: 438.38692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C=CC(=C2)[N+](=O)[O-])OCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C=CC(=C2)[N+](=O)[O-])OCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

InChI

InChI=1S/C22H18N2O8/c1-29-19-5-2-14(3-6-19)20-10-17(23(25)26)4-7-21(20)31-12-16-9-18(24(27)28)8-15-11-30-13-32-22(15)16/h2-10H,11-13H2,1H3