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Inherent Properties, Identifiers and References
ChemSpider ID: 396556
Empirical Formula: C21H23Cl18FNO2
Molecular Weight: 374.8668
Nominal Mass: 374 Da
Average Mass: 374.8668 Da
Monoisotopic Mass: 374.142669 Da
Systematic Name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-[4-(~18~F)fluoro​phenyl]butan-1-one
SMILES: c1cc(ccc1C(=O)CCCN2CCC(CC2)(c3ccc(cc3)Cl)O)F Copy
InChI: InChI=1/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21​)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2/i23-1 Copy
InChIKey: LNEPOXFFQSENCJ-VNRZBHCFEO
Std. InChI: InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-2​1)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2/i23-1 Copy
Std. InChIKey: LNEPOXFFQSENCJ-VNRZBHCFSA-N
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