(2S)-1-(2-fluoranylphenoxy)-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol

Systemtic Name: (2S)-1-(2-fluoranylphenoxy)-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol Openeye Name: (2S)-1-(2-fluorophenoxy)-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2S)-1-(2-fluorophenoxy)-3-(4-methyl-1-piperazin-4-iumyl)-2-propanol IUPAC Name: (2S)-1-(2-fluorophenoxy)-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol Traditional Name: (2S)-1-(2-fluorophenoxy)-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol Formula: C14H22FN2O2+ MolecularWeight: 269.335083

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC(COC2=CC=CC=C2F)O

Isomeric SMILES

C[NH+]1CCN(CC1)C[C@@H](COC2=CC=CC=C2F)O

InChI

InChI=1S/C14H21FN2O2/c1-16-6-8-17(9-7-16)10-12(18)11-19-14-5-3-2-4-13(14)15/h2-5,12,18H,6-11H2,1H3/p+1/t12-/m0/s1