2-[(2R)-3,3-dimethyl-1-(phenylmethyl)pyrrolidin-1-ium-2-yl]ethanenitrile

Systemtic Name: 2-[(2R)-3,3-dimethyl-1-(phenylmethyl)pyrrolidin-1-ium-2-yl]ethanenitrile Openeye Name: 2-[(2R)-1-benzyl-3,3-dimethyl-pyrrolidin-1-ium-2-yl]acetonitrile CAS Name: 2-[(2R)-3,3-dimethyl-1-(phenylmethyl)-2-pyrrolidin-1-iumyl]acetonitrile IUPAC Name: 2-[(2R)-1-benzyl-3,3-dimethylpyrrolidin-1-ium-2-yl]acetonitrile Traditional Name: 2-[(2R)-1-benzyl-3,3-dimethyl-pyrrolidin-1-ium-2-yl]acetonitrile Formula: C15H21N2+ MolecularWeight: 229.34064

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC[NH+](C1CC#N)CC2=CC=CC=C2)C

Isomeric SMILES

CC1(CC[NH+]([C@@H]1CC#N)CC2=CC=CC=C2)C

InChI

InChI=1S/C15H20N2/c1-15(2)9-11-17(14(15)8-10-16)12-13-6-4-3-5-7-13/h3-7,14H,8-9,11-12H2,1-2H3/p+1/t14-/m1/s1