N-[2-(1,3-dioxolan-2-yl)ethyl]-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[2-(1,3-dioxolan-2-yl)ethyl]-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-[2-(1,3-dioxolan-2-yl)ethyl]-6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-amine CAS Name: N-[2-(1,3-dioxolan-2-yl)ethyl]-6-(4-methyl-1-piperazinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-[2-(1,3-dioxolan-2-yl)ethyl]-6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: 2-(1,3-dioxolan-2-yl)ethyl-[6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]amine Formula: C14H22N6O4 MolecularWeight: 338.36228

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=NC=N2)NCCC3OCCO3)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=NC=N2)NCCC3OCCO3)[N+](=O)[O-]

InChI

InChI=1S/C14H22N6O4/c1-18-4-6-19(7-5-18)14-12(20(21)22)13(16-10-17-14)15-3-2-11-23-8-9-24-11/h10-11H,2-9H2,1H3,(H,15,16,17)