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

Systemtic Name: 4-[[(2R)-2-(3-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[(2R)-2-(3-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]benzonitrile CAS Name: 4-[[(2R)-2-(3-methoxyphenyl)-1-pyrrolidin-1-iumyl]methyl]benzonitrile IUPAC Name: 4-[[(2R)-2-(3-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]benzonitrile Traditional Name: 4-[[(2R)-2-(3-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]benzonitrile Formula: C19H21N2O+ MolecularWeight: 293.38284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O/c1-22-18-5-2-4-17(12-18)19-6-3-11-21(19)14-16-9-7-15(13-20)8-10-16/h2,4-5,7-10,12,19H,3,6,11,14H2,1H3/p+1/t19-/m1/s1