6-[[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-N2-naphthalen-2-yl-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-N2-naphthalen-2-yl-1,3,5-triazine-2,4-diamine Openeye Name: 6-[[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-N2-(2-naphthyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]methyl]-N2-(2-naphthalenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-2-N-naphthalen-2-yl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]-s-triazin-2-yl]-(2-naphthyl)amine Formula: C21H27N6+ MolecularWeight: 363.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC2=NC(=NC(=N2)NC3=CC4=CC=CC=C4C=C3)N)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)CC2=NC(=NC(=N2)NC3=CC4=CC=CC=C4C=C3)N)C

InChI

InChI=1S/C21H26N6/c1-14-9-15(2)12-27(11-14)13-19-24-20(22)26-21(25-19)23-18-8-7-16-5-3-4-6-17(16)10-18/h3-8,10,14-15H,9,11-13H2,1-2H3,(H3,22,23,24,25,26)/p+1/t14-,15-/m1/s1