4-[4-(4-bromophenyl)-4-oxidanyl-piperidin-1-ium-1-yl]-1-(4-fluorophenyl)butan-1-one

Systemtic Name: 4-[4-(4-bromophenyl)-4-oxidanyl-piperidin-1-ium-1-yl]-1-(4-fluorophenyl)butan-1-one Openeye Name: 4-[4-(4-bromophenyl)-4-hydroxy-piperidin-1-ium-1-yl]-1-(4-fluorophenyl)butan-1-one CAS Name: 4-[4-(4-bromophenyl)-4-hydroxy-1-piperidin-1-iumyl]-1-(4-fluorophenyl)-1-butanone IUPAC Name: 4-[4-(4-bromophenyl)-4-hydroxypiperidin-1-ium-1-yl]-1-(4-fluorophenyl)butan-1-one Traditional Name: 4-[4-(4-bromophenyl)-4-hydroxy-piperidin-1-ium-1-yl]-1-(4-fluorophenyl)butan-1-one Formula: C21H24BrFNO2+ MolecularWeight: 421.323163

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1(C2=CC=C(C=C2)Br)O)CCCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1C[NH+](CCC1(C2=CC=C(C=C2)Br)O)CCCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H23BrFNO2/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/p+1