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

Systemtic Name: 2-[(4-aminophenyl)methyl]-5-ethyl-6-[4-methoxy-3-(trifluoromethyloxy)phenyl]-4,5-dihydropyridazin-3-one Openeye Name: 2-[(4-aminophenyl)methyl]-5-ethyl-6-[4-methoxy-3-(trifluoromethoxy)phenyl]-4,5-dihydropyridazin-3-one CAS Name: 2-[(4-aminophenyl)methyl]-5-ethyl-6-[4-methoxy-3-(trifluoromethoxy)phenyl]-4,5-dihydropyridazin-3-one IUPAC Name: 2-[(4-aminophenyl)methyl]-5-ethyl-6-[4-methoxy-3-(trifluoromethoxy)phenyl]-4,5-dihydropyridazin-3-one Traditional Name: 2-(4-aminobenzyl)-5-ethyl-6-[4-methoxy-3-(trifluoromethoxy)phenyl]-4,5-dihydropyridazin-3-one Formula: C21H22F3N3O3 MolecularWeight: 421.41289

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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

Isomeric SMILES

CCC1CC(=O)N(N=C1C2=CC(=C(C=C2)OC)OC(F)(F)F)CC3=CC=C(C=C3)N

InChI

InChI=1S/C21H22F3N3O3/c1-3-14-11-19(28)27(12-13-4-7-16(25)8-5-13)26-20(14)15-6-9-17(29-2)18(10-15)30-21(22,23)24/h4-10,14H,3,11-12,25H2,1-2H3