2-[[4-(2,5-dimethyl-4-nitro-pyrazol-3-yl)piperazin-1-yl]methyl]-1H-imidazo[1,2-a]pyridin-4-ium

Systemtic Name: 2-[[4-(2,5-dimethyl-4-nitro-pyrazol-3-yl)piperazin-1-yl]methyl]-1H-imidazo[1,2-a]pyridin-4-ium Openeye Name: 2-[[4-(2,5-dimethyl-4-nitro-pyrazol-3-yl)piperazin-1-yl]methyl]-1H-imidazo[1,2-a]pyridin-4-ium CAS Name: 2-[[4-(2,5-dimethyl-4-nitro-3-pyrazolyl)-1-piperazinyl]methyl]-1H-imidazo[1,2-a]pyridin-4-ium IUPAC Name: 2-[[4-(2,5-dimethyl-4-nitropyrazol-3-yl)piperazin-1-yl]methyl]-1H-imidazo[1,2-a]pyridin-4-ium Traditional Name: 2-[[4-(2,5-dimethyl-4-nitro-pyrazol-3-yl)piperazino]methyl]-1H-imidazo[1,2-a]pyridin-4-ium Formula: C17H22N7O2+ MolecularWeight: 356.40228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])N2CCN(CC2)CC3=C[N+]4=CC=CC=C4N3)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])N2CCN(CC2)CC3=C[N+]4=CC=CC=C4N3)C

InChI

InChI=1S/C17H21N7O2/c1-13-16(24(25)26)17(20(2)19-13)22-9-7-21(8-10-22)11-14-12-23-6-4-3-5-15(23)18-14/h3-6,12H,7-11H2,1-2H3/p+1