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

Systemtic Name: 4-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]benzonitrile CAS Name: 4-[[(2R)-2-(4-ethoxyphenyl)-1-pyrrolidin-1-iumyl]methyl]benzonitrile IUPAC Name: 4-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]benzonitrile Traditional Name: 4-[[(2R)-2-p-phenetylpyrrolidin-1-ium-1-yl]methyl]benzonitrile Formula: C20H23N2O+ MolecularWeight: 307.40942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCC[NH+]2CC3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H]2CCC[NH+]2CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H22N2O/c1-2-23-19-11-9-18(10-12-19)20-4-3-13-22(20)15-17-7-5-16(14-21)6-8-17/h5-12,20H,2-4,13,15H2,1H3/p+1/t20-/m1/s1