4-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]methyl]-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]methyl]-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]methyl]-3-fluoro-benzonitrile CAS Name: 4-[[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methylamino]methyl]-3-fluorobenzonitrile IUPAC Name: 4-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]methyl]-3-fluorobenzonitrile Traditional Name: 4-[[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]methyl]-3-fluoro-benzonitrile Formula: C15H21FN3+ MolecularWeight: 262.345743

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNCC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNCC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C15H20FN3/c1-2-19-7-3-4-14(19)11-18-10-13-6-5-12(9-17)8-15(13)16/h5-6,8,14,18H,2-4,7,10-11H2,1H3/p+1/t14-/m0/s1