2-[2-[[4-azanyl-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-2-yl]amino]ethoxy]ethanol

Systemtic Name: 2-[2-[[4-azanyl-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-2-yl]amino]ethoxy]ethanol Openeye Name: 2-[2-[[4-amino-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-2-yl]amino]ethoxy]ethanol CAS Name: 2-[2-[[4-amino-6-(4-methyl-1-piperazinyl)-5-nitro-2-pyrimidinyl]amino]ethoxy]ethanol IUPAC Name: 2-[2-[[4-amino-6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-2-yl]amino]ethoxy]ethanol Traditional Name: 2-[2-[[4-amino-6-(4-methylpiperazino)-5-nitro-pyrimidin-2-yl]amino]ethoxy]ethanol Formula: C13H23N7O4 MolecularWeight: 341.36622

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=NC(=N2)NCCOCCO)N)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=NC(=N2)NCCOCCO)N)[N+](=O)[O-]

InChI

InChI=1S/C13H23N7O4/c1-18-3-5-19(6-4-18)12-10(20(22)23)11(14)16-13(17-12)15-2-8-24-9-7-21/h21H,2-9H2,1H3,(H3,14,15,16,17)