6-(4-ethylpiperazin-4-ium-1-yl)-N2-methyl-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: 6-(4-ethylpiperazin-4-ium-1-yl)-N2-methyl-5-nitro-pyrimidine-2,4-diamine Openeye Name: 6-(4-ethylpiperazin-4-ium-1-yl)-N2-methyl-5-nitro-pyrimidine-2,4-diamine CAS Name: 6-(4-ethyl-1-piperazin-4-iumyl)-N2-methyl-5-nitropyrimidine-2,4-diamine IUPAC Name: 6-(4-ethylpiperazin-4-ium-1-yl)-2-N-methyl-5-nitropyrimidine-2,4-diamine Traditional Name: [4-amino-6-(4-ethylpiperazin-4-ium-1-yl)-5-nitro-pyrimidin-2-yl]-methyl-amine Formula: C11H20N7O2+ MolecularWeight: 282.3222

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C(=NC(=N2)NC)N)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C(=NC(=N2)NC)N)[N+](=O)[O-]

InChI

InChI=1S/C11H19N7O2/c1-3-16-4-6-17(7-5-16)10-8(18(19)20)9(12)14-11(13-2)15-10/h3-7H2,1-2H3,(H3,12,13,14,15)/p+1