2-[[1-[2,4-bis(fluoranyl)phenyl]carbonylpiperidin-4-yl]methyl]-6-phenyl-pyridazin-3-one

Systemtic Name: 2-[[1-[2,4-bis(fluoranyl)phenyl]carbonylpiperidin-4-yl]methyl]-6-phenyl-pyridazin-3-one Openeye Name: 2-[[1-(2,4-difluorobenzoyl)-4-piperidyl]methyl]-6-phenyl-pyridazin-3-one CAS Name: 2-[[1-[(2,4-difluorophenyl)-oxomethyl]-4-piperidinyl]methyl]-6-phenyl-3-pyridazinone IUPAC Name: 2-[[1-(2,4-difluorobenzoyl)piperidin-4-yl]methyl]-6-phenylpyridazin-3-one Traditional Name: 2-[[1-(2,4-difluorobenzoyl)-4-piperidyl]methyl]-6-phenyl-pyridazin-3-one Formula: C23H21F2N3O2 MolecularWeight: 409.428546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C(=O)C=CC(=N2)C3=CC=CC=C3)C(=O)C4=C(C=C(C=C4)F)F

Isomeric SMILES

C1CN(CCC1CN2C(=O)C=CC(=N2)C3=CC=CC=C3)C(=O)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C23H21F2N3O2/c24-18-6-7-19(20(25)14-18)23(30)27-12-10-16(11-13-27)15-28-22(29)9-8-21(26-28)17-4-2-1-3-5-17/h1-9,14,16H,10-13,15H2