2-[1,1-bis[(4-methylphenyl)methyl]aziridin-1-ium-2-yl]ethanenitrile

Systemtic Name: 2-[1,1-bis[(4-methylphenyl)methyl]aziridin-1-ium-2-yl]ethanenitrile Openeye Name: 2-[1,1-bis(p-tolylmethyl)aziridin-1-ium-2-yl]acetonitrile CAS Name: 2-[1,1-bis[(4-methylphenyl)methyl]-2-aziridin-1-iumyl]acetonitrile IUPAC Name: 2-[1,1-bis[(4-methylphenyl)methyl]aziridin-1-ium-2-yl]acetonitrile Traditional Name: 2-[1,1-bis(4-methylbenzyl)ethylenimin-1-ium-2-yl]acetonitrile Formula: C20H23N2+ MolecularWeight: 291.41002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]2(CC2CC#N)CC3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]2(CC2CC#N)CC3=CC=C(C=C3)C

InChI

InChI=1S/C20H23N2/c1-16-3-7-18(8-4-16)13-22(15-20(22)11-12-21)14-19-9-5-17(2)6-10-19/h3-10,20H,11,13-15H2,1-2H3/q+1