4-butoxy-6-(furan-2-yl)-5-nitro-pyrimidin-2-amine

Systemtic Name: 4-butoxy-6-(furan-2-yl)-5-nitro-pyrimidin-2-amine Openeye Name: 4-butoxy-6-(2-furyl)-5-nitro-pyrimidin-2-amine CAS Name: 4-butoxy-6-(2-furanyl)-5-nitro-2-pyrimidinamine IUPAC Name: 4-butoxy-6-(furan-2-yl)-5-nitropyrimidin-2-amine Traditional Name: [4-butoxy-6-(2-furyl)-5-nitro-pyrimidin-2-yl]amine Formula: C12H14N4O4 MolecularWeight: 278.26396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC(=NC(=C1[N+](=O)[O-])C2=CC=CO2)N

Isomeric SMILES

CCCCOC1=NC(=NC(=C1[N+](=O)[O-])C2=CC=CO2)N

InChI

InChI=1S/C12H14N4O4/c1-2-3-6-20-11-10(16(17)18)9(14-12(13)15-11)8-5-4-7-19-8/h4-5,7H,2-3,6H2,1H3,(H2,13,14,15)