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

Systemtic Name: 6-(4-ethylpiperazin-4-ium-1-yl)-5-nitro-2-piperidin-1-yl-pyrimidin-4-amine Openeye Name: 6-(4-ethylpiperazin-4-ium-1-yl)-5-nitro-2-(1-piperidyl)pyrimidin-4-amine CAS Name: 6-(4-ethyl-1-piperazin-4-iumyl)-5-nitro-2-(1-piperidinyl)-4-pyrimidinamine IUPAC Name: 6-(4-ethylpiperazin-4-ium-1-yl)-5-nitro-2-piperidin-1-ylpyrimidin-4-amine Traditional Name: [6-(4-ethylpiperazin-4-ium-1-yl)-5-nitro-2-piperidino-pyrimidin-4-yl]amine Formula: C15H26N7O2+ MolecularWeight: 336.41264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C(=NC(=N2)N3CCCCC3)N)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C(=NC(=N2)N3CCCCC3)N)[N+](=O)[O-]

InChI

InChI=1S/C15H25N7O2/c1-2-19-8-10-20(11-9-19)14-12(22(23)24)13(16)17-15(18-14)21-6-4-3-5-7-21/h2-11H2,1H3,(H2,16,17,18)/p+1