6-piperidin-1-yl-4-[(4-pyridin-2-ylpiperazin-1-ium-1-yl)methyl]-1,3,5-triazin-1-ium-2-amine

Systemtic Name: 6-piperidin-1-yl-4-[(4-pyridin-2-ylpiperazin-1-ium-1-yl)methyl]-1,3,5-triazin-1-ium-2-amine Openeye Name: 6-(1-piperidyl)-4-[[4-(2-pyridyl)piperazin-1-ium-1-yl]methyl]-1,3,5-triazin-1-ium-2-amine CAS Name: 6-(1-piperidinyl)-4-[[4-(2-pyridinyl)-1-piperazin-1-iumyl]methyl]-1,3,5-triazin-1-ium-2-amine IUPAC Name: 6-piperidin-1-yl-4-[(4-pyridin-2-ylpiperazin-1-ium-1-yl)methyl]-1,3,5-triazin-1-ium-2-amine Traditional Name: [6-piperidino-4-[[4-(2-pyridyl)piperazin-1-ium-1-yl]methyl]-s-triazin-1-ium-2-yl]amine Formula: C18H28N8+2 MolecularWeight: 356.46852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=[NH+]C(=NC(=N2)C[NH+]3CCN(CC3)C4=CC=CC=N4)N

Isomeric SMILES

C1CCN(CC1)C2=[NH+]C(=NC(=N2)C[NH+]3CCN(CC3)C4=CC=CC=N4)N

InChI

InChI=1S/C18H26N8/c19-17-21-15(22-18(23-17)26-8-4-1-5-9-26)14-24-10-12-25(13-11-24)16-6-2-3-7-20-16/h2-3,6-7H,1,4-5,8-14H2,(H2,19,21,22,23)/p+2