2-(4-ethylpiperazin-4-ium-1-yl)-6-morpholin-4-yl-5-nitro-pyrimidin-4-amine

Systemtic Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-morpholin-4-yl-5-nitro-pyrimidin-4-amine Openeye Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-morpholino-5-nitro-pyrimidin-4-amine CAS Name: 2-(4-ethyl-1-piperazin-4-iumyl)-6-(4-morpholinyl)-5-nitro-4-pyrimidinamine IUPAC Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-morpholin-4-yl-5-nitropyrimidin-4-amine Traditional Name: [2-(4-ethylpiperazin-4-ium-1-yl)-6-morpholino-5-nitro-pyrimidin-4-yl]amine Formula: C14H24N7O3+ MolecularWeight: 338.38546

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC(=C(C(=N2)N)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC(=C(C(=N2)N)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C14H23N7O3/c1-2-18-3-5-20(6-4-18)14-16-12(15)11(21(22)23)13(17-14)19-7-9-24-10-8-19/h2-10H2,1H3,(H2,15,16,17)/p+1