5-ethyl-6-[4-methoxy-3-(trifluoromethyloxy)phenyl]-2-[(4-nitrophenyl)methyl]-4,5-dihydropyridazin-3-one

Systemtic Name: 5-ethyl-6-[4-methoxy-3-(trifluoromethyloxy)phenyl]-2-[(4-nitrophenyl)methyl]-4,5-dihydropyridazin-3-one Openeye Name: 5-ethyl-6-[4-methoxy-3-(trifluoromethoxy)phenyl]-2-[(4-nitrophenyl)methyl]-4,5-dihydropyridazin-3-one CAS Name: 5-ethyl-6-[4-methoxy-3-(trifluoromethoxy)phenyl]-2-[(4-nitrophenyl)methyl]-4,5-dihydropyridazin-3-one IUPAC Name: 5-ethyl-6-[4-methoxy-3-(trifluoromethoxy)phenyl]-2-[(4-nitrophenyl)methyl]-4,5-dihydropyridazin-3-one Traditional Name: 5-ethyl-6-[4-methoxy-3-(trifluoromethoxy)phenyl]-2-(4-nitrobenzyl)-4,5-dihydropyridazin-3-one Formula: C21H20F3N3O5 MolecularWeight: 451.39581

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(=O)N(N=C1C2=CC(=C(C=C2)OC)OC(F)(F)F)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1CC(=O)N(N=C1C2=CC(=C(C=C2)OC)OC(F)(F)F)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20F3N3O5/c1-3-14-11-19(28)26(12-13-4-7-16(8-5-13)27(29)30)25-20(14)15-6-9-17(31-2)18(10-15)32-21(22,23)24/h4-10,14H,3,11-12H2,1-2H3