2-[[4-(5-nitropyridin-2-yl)piperazin-1-yl]methyl]-1H-imidazo[1,2-a]pyridin-4-ium

Systemtic Name: 2-[[4-(5-nitropyridin-2-yl)piperazin-1-yl]methyl]-1H-imidazo[1,2-a]pyridin-4-ium Openeye Name: 2-[[4-(5-nitro-2-pyridyl)piperazin-1-yl]methyl]-1H-imidazo[1,2-a]pyridin-4-ium CAS Name: 2-[[4-(5-nitro-2-pyridinyl)-1-piperazinyl]methyl]-1H-imidazo[1,2-a]pyridin-4-ium IUPAC Name: 2-[[4-(5-nitropyridin-2-yl)piperazin-1-yl]methyl]-1H-imidazo[1,2-a]pyridin-4-ium Traditional Name: 2-[[4-(5-nitro-2-pyridyl)piperazino]methyl]-1H-imidazo[1,2-a]pyridin-4-ium Formula: C17H19N6O2+ MolecularWeight: 339.37176

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C[N+]3=CC=CC=C3N2)C4=NC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=C[N+]3=CC=CC=C3N2)C4=NC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H18N6O2/c24-23(25)15-4-5-16(18-11-15)21-9-7-20(8-10-21)12-14-13-22-6-2-1-3-17(22)19-14/h1-6,11,13H,7-10,12H2/p+1