(2R)-1-(3-bromanylphenoxy)-3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2R)-1-(3-bromanylphenoxy)-3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propan-2-ol Openeye Name: (2R)-1-(3-bromophenoxy)-3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-(3-bromophenoxy)-3-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-(3-bromophenoxy)-3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propan-2-ol Traditional Name: (2R)-1-(3-bromophenoxy)-3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C19H23BrFN2O2+ MolecularWeight: 410.300523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(COC2=CC(=CC=C2)Br)O)C3=CC=CC=C3F

Isomeric SMILES

C1CN(CC[NH+]1C[C@H](COC2=CC(=CC=C2)Br)O)C3=CC=CC=C3F

InChI

InChI=1S/C19H22BrFN2O2/c20-15-4-3-5-17(12-15)25-14-16(24)13-22-8-10-23(11-9-22)19-7-2-1-6-18(19)21/h1-7,12,16,24H,8-11,13-14H2/p+1/t16-/m1/s1