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

Systemtic Name: 2-[1-[(4-methylphenyl)methyl]-1-(phenylmethyl)aziridin-1-ium-2-yl]ethanenitrile Openeye Name: 2-[1-benzyl-1-(p-tolylmethyl)aziridin-1-ium-2-yl]acetonitrile CAS Name: 2-[1-[(4-methylphenyl)methyl]-1-(phenylmethyl)-2-aziridin-1-iumyl]acetonitrile IUPAC Name: 2-[1-benzyl-1-[(4-methylphenyl)methyl]aziridin-1-ium-2-yl]acetonitrile Traditional Name: 2-[1-benzyl-1-(4-methylbenzyl)ethylenimin-1-ium-2-yl]acetonitrile Formula: C19H21N2+ MolecularWeight: 277.38344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N2/c1-16-7-9-18(10-8-16)14-21(15-19(21)11-12-20)13-17-5-3-2-4-6-17/h2-10,19H,11,13-15H2,1H3/q+1