N-(1,2-dinitrocyclohexa-2,4-dien-1-yl)-1-[2-methoxy-5-(trifluoromethyloxy)phenyl]methanimine

Systemtic Name: N-(1,2-dinitrocyclohexa-2,4-dien-1-yl)-1-[2-methoxy-5-(trifluoromethyloxy)phenyl]methanimine Openeye Name: N-(1,2-dinitrocyclohexa-2,4-dien-1-yl)-1-[2-methoxy-5-(trifluoromethoxy)phenyl]methanimine CAS Name: N-(1,2-dinitro-1-cyclohexa-2,4-dienyl)-1-[2-methoxy-5-(trifluoromethoxy)phenyl]methanimine IUPAC Name: N-(1,2-dinitrocyclohexa-2,4-dien-1-yl)-1-[2-methoxy-5-(trifluoromethoxy)phenyl]methanimine Traditional Name: (E)-(1,2-dinitrocyclohexa-2,4-dien-1-yl)-[2-methoxy-5-(trifluoromethoxy)benzylidene]amine Formula: C15H12F3N3O6 MolecularWeight: 387.26749

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)OC(F)(F)F)C=NC2(CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)OC(F)(F)F)/C=N/C2(CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H12F3N3O6/c1-26-12-6-5-11(27-15(16,17)18)8-10(12)9-19-14(21(24)25)7-3-2-4-13(14)20(22)23/h2-6,8-9H,7H2,1H3/b19-9+