2-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxy-5-fluoranyl-aniline

Systemtic Name: 2-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxy-5-fluoranyl-aniline Openeye Name: 2-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxy-5-fluoro-aniline CAS Name: 2-[[(3S)-1-ethyl-3-piperidin-1-iumyl]oxy]-5-fluoroaniline IUPAC Name: 2-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxy-5-fluoroaniline Traditional Name: [2-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxy-5-fluoro-phenyl]amine Formula: C13H20FN2O+ MolecularWeight: 239.309103

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC(C1)OC2=C(C=C(C=C2)F)N

Isomeric SMILES

CC[NH+]1CCC[C@@H](C1)OC2=C(C=C(C=C2)F)N

InChI

InChI=1S/C13H19FN2O/c1-2-16-7-3-4-11(9-16)17-13-6-5-10(14)8-12(13)15/h5-6,8,11H,2-4,7,9,15H2,1H3/p+1/t11-/m0/s1