N2-(2-methylphenyl)-6-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(2-methylphenyl)-6-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(4-methylpiperidin-1-ium-1-yl)methyl]-N2-(o-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(2-methylphenyl)-6-[(4-methyl-1-piperidin-1-iumyl)methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(2-methylphenyl)-6-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(4-methylpiperidin-1-ium-1-yl)methyl]-s-triazin-2-yl]-(o-tolyl)amine Formula: C17H25N6+ MolecularWeight: 313.4206

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=NC(=NC(=N2)NC3=CC=CC=C3C)N

Isomeric SMILES

CC1CC[NH+](CC1)CC2=NC(=NC(=N2)NC3=CC=CC=C3C)N

InChI

InChI=1S/C17H24N6/c1-12-7-9-23(10-8-12)11-15-20-16(18)22-17(21-15)19-14-6-4-3-5-13(14)2/h3-6,12H,7-11H2,1-2H3,(H3,18,19,20,21,22)/p+1