4-bromanyl-5-[[4-[3-(3-fluorophenyl)propyl]piperidin-1-yl]methyl]-1-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-bromanyl-5-[[4-[3-(3-fluorophenyl)propyl]piperidin-1-yl]methyl]-1-methyl-2-phenyl-pyrazol-3-one Openeye Name: 4-bromo-5-[[4-[3-(3-fluorophenyl)propyl]-1-piperidyl]methyl]-1-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-bromo-5-[[4-[3-(3-fluorophenyl)propyl]-1-piperidinyl]methyl]-1-methyl-2-phenyl-3-pyrazolone IUPAC Name: 4-bromo-5-[[4-[3-(3-fluorophenyl)propyl]piperidin-1-yl]methyl]-1-methyl-2-phenylpyrazol-3-one Traditional Name: 4-bromo-5-[[4-[3-(3-fluorophenyl)propyl]piperidino]methyl]-1-methyl-2-phenyl-3-pyrazolin-3-one Formula: C25H29BrFN3O MolecularWeight: 486.419663

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C2=CC=CC=C2)Br)CN3CCC(CC3)CCCC4=CC(=CC=C4)F

Isomeric SMILES

CN1C(=C(C(=O)N1C2=CC=CC=C2)Br)CN3CCC(CC3)CCCC4=CC(=CC=C4)F

InChI

InChI=1S/C25H29BrFN3O/c1-28-23(24(26)25(31)30(28)22-11-3-2-4-12-22)18-29-15-13-19(14-16-29)7-5-8-20-9-6-10-21(27)17-20/h2-4,6,9-12,17,19H,5,7-8,13-16,18H2,1H3