2-[(5S)-3-(4-methylphenyl)-5-(phenylmethyl)imidazolidin-1-ium-1-yl]ethanenitrile

Systemtic Name: 2-[(5S)-3-(4-methylphenyl)-5-(phenylmethyl)imidazolidin-1-ium-1-yl]ethanenitrile Openeye Name: 2-[(5S)-5-benzyl-3-(p-tolyl)imidazolidin-1-ium-1-yl]acetonitrile CAS Name: 2-[(5S)-3-(4-methylphenyl)-5-(phenylmethyl)-1-imidazolidin-1-iumyl]acetonitrile IUPAC Name: 2-[(5S)-5-benzyl-3-(4-methylphenyl)imidazolidin-1-ium-1-yl]acetonitrile Traditional Name: 2-[(5S)-5-benzyl-3-(p-tolyl)imidazolidin-1-ium-1-yl]acetonitrile Formula: C19H22N3+ MolecularWeight: 292.39808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC([NH+](C2)CC#N)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C[C@@H]([NH+](C2)CC#N)CC3=CC=CC=C3

InChI

InChI=1S/C19H21N3/c1-16-7-9-18(10-8-16)22-14-19(21(15-22)12-11-20)13-17-5-3-2-4-6-17/h2-10,19H,12-15H2,1H3/p+1/t19-/m0/s1