2-(4-fluorophenyl)-5-methoxy-6-[4-(phenylmethyl)piperidin-1-yl]carbonyl-pyridazin-3-one

Systemtic Name: 2-(4-fluorophenyl)-5-methoxy-6-[4-(phenylmethyl)piperidin-1-yl]carbonyl-pyridazin-3-one Openeye Name: 6-(4-benzylpiperidine-1-carbonyl)-2-(4-fluorophenyl)-5-methoxy-pyridazin-3-one CAS Name: 2-(4-fluorophenyl)-5-methoxy-6-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-3-pyridazinone IUPAC Name: 6-(4-benzylpiperidine-1-carbonyl)-2-(4-fluorophenyl)-5-methoxypyridazin-3-one Traditional Name: 6-(4-benzylpiperidine-1-carbonyl)-2-(4-fluorophenyl)-5-methoxy-pyridazin-3-one Formula: C24H24FN3O3 MolecularWeight: 421.464063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)N(N=C1C(=O)N2CCC(CC2)CC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC(=O)N(N=C1C(=O)N2CCC(CC2)CC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H24FN3O3/c1-31-21-16-22(29)28(20-9-7-19(25)8-10-20)26-23(21)24(30)27-13-11-18(12-14-27)15-17-5-3-2-4-6-17/h2-10,16,18H,11-15H2,1H3