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

Systemtic Name: (2R)-1-butoxy-3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propan-2-ol Openeye Name: (2R)-1-butoxy-3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-butoxy-3-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-butoxy-3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propan-2-ol Traditional Name: (2R)-1-butoxy-3-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C17H28FN2O2+ MolecularWeight: 311.414823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(C[NH+]1CCN(CC1)C2=CC=CC=C2F)O

Isomeric SMILES

CCCCOC[C@@H](C[NH+]1CCN(CC1)C2=CC=CC=C2F)O

InChI

InChI=1S/C17H27FN2O2/c1-2-3-12-22-14-15(21)13-19-8-10-20(11-9-19)17-7-5-4-6-16(17)18/h4-7,15,21H,2-3,8-14H2,1H3/p+1/t15-/m1/s1