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

Systemtic Name: 4-bromanyl-1-ethyl-5-[[4-[3-(3-fluorophenyl)propyl]piperidin-1-yl]methyl]-2-phenyl-pyrazol-3-one Openeye Name: 4-bromo-1-ethyl-5-[[4-[3-(3-fluorophenyl)propyl]-1-piperidyl]methyl]-2-phenyl-pyrazol-3-one CAS Name: 4-bromo-1-ethyl-5-[[4-[3-(3-fluorophenyl)propyl]-1-piperidinyl]methyl]-2-phenyl-3-pyrazolone IUPAC Name: 4-bromo-1-ethyl-5-[[4-[3-(3-fluorophenyl)propyl]piperidin-1-yl]methyl]-2-phenylpyrazol-3-one Traditional Name: 4-bromo-1-ethyl-5-[[4-[3-(3-fluorophenyl)propyl]piperidino]methyl]-2-phenyl-3-pyrazolin-3-one Formula: C26H31BrFN3O MolecularWeight: 500.446243

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=O)N1C2=CC=CC=C2)Br)CN3CCC(CC3)CCCC4=CC(=CC=C4)F

Isomeric SMILES

CCN1C(=C(C(=O)N1C2=CC=CC=C2)Br)CN3CCC(CC3)CCCC4=CC(=CC=C4)F

InChI

InChI=1S/C26H31BrFN3O/c1-2-30-24(25(27)26(32)31(30)23-12-4-3-5-13-23)19-29-16-14-20(15-17-29)8-6-9-21-10-7-11-22(28)18-21/h3-5,7,10-13,18,20H,2,6,8-9,14-17,19H2,1H3