1-[[(5S)-5-methyl-3-(4-methylphenyl)imidazolidin-1-ium-1-yl]methyl]benzotriazole

Systemtic Name: 1-[[(5S)-5-methyl-3-(4-methylphenyl)imidazolidin-1-ium-1-yl]methyl]benzotriazole Openeye Name: 1-[[(5S)-5-methyl-3-(p-tolyl)imidazolidin-1-ium-1-yl]methyl]benzotriazole CAS Name: 1-[[(5S)-5-methyl-3-(4-methylphenyl)-1-imidazolidin-1-iumyl]methyl]benzotriazole IUPAC Name: 1-[[(5S)-5-methyl-3-(4-methylphenyl)imidazolidin-1-ium-1-yl]methyl]benzotriazole Traditional Name: 1-[[(5S)-5-methyl-3-(p-tolyl)imidazolidin-1-ium-1-yl]methyl]benzotriazole Formula: C18H22N5+ MolecularWeight: 308.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C[NH+]1CN2C3=CC=CC=C3N=N2)C4=CC=C(C=C4)C

Isomeric SMILES

C[C@H]1CN(C[NH+]1CN2C3=CC=CC=C3N=N2)C4=CC=C(C=C4)C

InChI

InChI=1S/C18H21N5/c1-14-7-9-16(10-8-14)21-11-15(2)22(12-21)13-23-18-6-4-3-5-17(18)19-20-23/h3-10,15H,11-13H2,1-2H3/p+1/t15-/m0/s1