[1-[1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]-1,2,3-triazol-4-yl]methylazanium

Systemtic Name: [1-[1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]-1,2,3-triazol-4-yl]methylazanium Openeye Name: [1-[1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]triazol-4-yl]methylammonium CAS Name: [1-[1-[[1-(2-pyrimidinyl)-2-pyrrolyl]methyl]-4-piperidin-1-iumyl]-4-triazolyl]methylammonium IUPAC Name: [1-[1-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]triazol-4-yl]methylazanium Traditional Name: [1-[1-[[1-(2-pyrimidyl)pyrrol-2-yl]methyl]piperidin-1-ium-4-yl]triazol-4-yl]methylammonium Formula: C17H24N8+2 MolecularWeight: 340.42606

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C=C(N=N2)C[NH3+])CC3=CC=CN3C4=NC=CC=N4

Isomeric SMILES

C1C[NH+](CCC1N2C=C(N=N2)C[NH3+])CC3=CC=CN3C4=NC=CC=N4

InChI

InChI=1S/C17H22N8/c18-11-14-12-25(22-21-14)15-4-9-23(10-5-15)13-16-3-1-8-24(16)17-19-6-2-7-20-17/h1-3,6-8,12,15H,4-5,9-11,13,18H2/p+2