2-[(2S)-4-[(4-fluoranyl-3-methoxy-phenyl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(4-fluoranyl-3-methoxy-phenyl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(4-fluoro-3-methoxy-phenyl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(4-fluoro-3-methoxyphenyl)methyl]-1-methyl-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(4-fluoro-3-methoxyphenyl)methyl]-1-methylpiperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-(4-fluoro-3-methoxy-benzyl)-1-methyl-piperazin-1-ium-2-yl]ethanol Formula: C15H24FN2O2+ MolecularWeight: 283.361663

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1CCO)CC2=CC(=C(C=C2)F)OC

Isomeric SMILES

C[NH+]1CCN(C[C@@H]1CCO)CC2=CC(=C(C=C2)F)OC

InChI

InChI=1S/C15H23FN2O2/c1-17-6-7-18(11-13(17)5-8-19)10-12-3-4-14(16)15(9-12)20-2/h3-4,9,13,19H,5-8,10-11H2,1-2H3/p+1/t13-/m0/s1