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

Systemtic Name: (2R)-1-(4-bromanylphenoxy)-3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propan-2-ol Openeye Name: (2R)-1-(4-bromophenoxy)-3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-(4-bromophenoxy)-3-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-(4-bromophenoxy)-3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propan-2-ol Traditional Name: (2R)-1-(4-bromophenoxy)-3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C19H23BrClN2O2+ MolecularWeight: 426.75512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22BrClN2O2/c20-15-4-6-19(7-5-15)25-14-18(24)13-22-8-10-23(11-9-22)17-3-1-2-16(21)12-17/h1-7,12,18,24H,8-11,13-14H2/p+1/t18-/m1/s1