4-fluoranyl-3-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-fluoranyl-3-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-fluoro-3-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]benzonitrile CAS Name: 4-fluoro-3-[[(2R)-2-(4-methoxyphenyl)-1-pyrrolidin-1-iumyl]methyl]benzonitrile IUPAC Name: 4-fluoro-3-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]benzonitrile Traditional Name: 4-fluoro-3-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]benzonitrile Formula: C19H20FN2O+ MolecularWeight: 311.373303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCC[NH+]2CC3=C(C=CC(=C3)C#N)F

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCC[NH+]2CC3=C(C=CC(=C3)C#N)F

InChI

InChI=1S/C19H19FN2O/c1-23-17-7-5-15(6-8-17)19-3-2-10-22(19)13-16-11-14(12-21)4-9-18(16)20/h4-9,11,19H,2-3,10,13H2,1H3/p+1/t19-/m1/s1