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

Systemtic Name: N2-(2-ethylphenyl)-6-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-(2-ethylphenyl)-6-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-(2-ethylphenyl)-6-[(4-methyl-1-piperidin-1-iumyl)methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(2-ethylphenyl)-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]-(2-ethylphenyl)amine Formula: C18H27N6+ MolecularWeight: 327.44718

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)C[NH+]3CCC(CC3)C

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)C[NH+]3CCC(CC3)C

InChI

InChI=1S/C18H26N6/c1-3-14-6-4-5-7-15(14)20-18-22-16(21-17(19)23-18)12-24-10-8-13(2)9-11-24/h4-7,13H,3,8-12H2,1-2H3,(H3,19,20,21,22,23)/p+1