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

Systemtic Name: 6-methyl-3-(4-phenethylpiperidin-1-yl)carbonyl-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one Openeye Name: 6-methyl-3-(4-phenethylpiperidine-1-carbonyl)-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one CAS Name: 6-methyl-3-[oxo-(4-phenethyl-1-piperidinyl)methyl]-1-[3-(trifluoromethyl)phenyl]-4-pyridazinone IUPAC Name: 6-methyl-3-(4-phenethylpiperidine-1-carbonyl)-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one Traditional Name: 6-methyl-3-(4-phenethylpiperidine-1-carbonyl)-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one Formula: C26H26F3N3O2 MolecularWeight: 469.49875

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)N3CCC(CC3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)N3CCC(CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C26H26F3N3O2/c1-18-16-23(33)24(30-32(18)22-9-5-8-21(17-22)26(27,28)29)25(34)31-14-12-20(13-15-31)11-10-19-6-3-2-4-7-19/h2-9,16-17,20H,10-15H2,1H3