6-methyl-3-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one

Systemtic Name: 6-methyl-3-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Openeye Name: 6-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one CAS Name: 6-methyl-3-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-1-[2-(trifluoromethyl)phenyl]-4-pyridazinone IUPAC Name: 6-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Traditional Name: 6-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Formula: C23H20F3N5O4 MolecularWeight: 487.43121

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H20F3N5O4/c1-15-14-20(32)21(27-30(15)19-5-3-2-4-18(19)23(24,25)26)22(33)29-12-10-28(11-13-29)16-6-8-17(9-7-16)31(34)35/h2-9,14H,10-13H2,1H3