2-[[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol

Systemtic Name: 2-[[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol Openeye Name: 2-[[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol CAS Name: 2-[[6-(3,5-dimethylphenoxy)-5-nitro-4-pyrimidinyl]-ethylamino]ethanol IUPAC Name: 2-[[6-(3,5-dimethylphenoxy)-5-nitropyrimidin-4-yl]-ethylamino]ethanol Traditional Name: 2-[[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCO)C1=C(C(=NC=N1)OC2=CC(=CC(=C2)C)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CCO)C1=C(C(=NC=N1)OC2=CC(=CC(=C2)C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O4/c1-4-19(5-6-21)15-14(20(22)23)16(18-10-17-15)24-13-8-11(2)7-12(3)9-13/h7-10,21H,4-6H2,1-3H3