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

Systemtic Name: 3-[4-(2-hydroxyphenyl)piperazin-1-yl]carbonyl-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Openeye Name: 3-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one CAS Name: 3-[[4-(2-hydroxyphenyl)-1-piperazinyl]-oxomethyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]-4-pyridazinone IUPAC Name: 3-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Traditional Name: 3-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Formula: C23H21F3N4O3 MolecularWeight: 458.43305

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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=CC=C4O

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)N3CCN(CC3)C4=CC=CC=C4O

InChI

InChI=1S/C23H21F3N4O3/c1-15-14-20(32)21(27-30(15)17-7-3-2-6-16(17)23(24,25)26)22(33)29-12-10-28(11-13-29)18-8-4-5-9-19(18)31/h2-9,14,31H,10-13H2,1H3