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

Systemtic Name: N2-(2-methoxy-5-methyl-phenyl)-6-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-(2-methoxy-5-methyl-phenyl)-6-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-(2-methoxy-5-methylphenyl)-6-[(4-methyl-1-piperidin-1-iumyl)methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(2-methoxy-5-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]-(2-methoxy-5-methyl-phenyl)amine Formula: C18H27N6O+ MolecularWeight: 343.44658

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=NC(=NC(=N2)NC3=C(C=CC(=C3)C)OC)N

Isomeric SMILES

CC1CC[NH+](CC1)CC2=NC(=NC(=N2)NC3=C(C=CC(=C3)C)OC)N

InChI

InChI=1S/C18H26N6O/c1-12-6-8-24(9-7-12)11-16-21-17(19)23-18(22-16)20-14-10-13(2)4-5-15(14)25-3/h4-5,10,12H,6-9,11H2,1-3H3,(H3,19,20,21,22,23)/p+1