2-[[6-(dimethylamino)-5-nitro-pyrimidin-4-yl]-methyl-amino]ethanenitrile

Systemtic Name: 2-[[6-(dimethylamino)-5-nitro-pyrimidin-4-yl]-methyl-amino]ethanenitrile Openeye Name: 2-[[6-(dimethylamino)-5-nitro-pyrimidin-4-yl]-methyl-amino]acetonitrile CAS Name: 2-[[6-(dimethylamino)-5-nitro-4-pyrimidinyl]-methylamino]acetonitrile IUPAC Name: 2-[[6-(dimethylamino)-5-nitropyrimidin-4-yl]-methylamino]acetonitrile Traditional Name: 2-[[6-(dimethylamino)-5-nitro-pyrimidin-4-yl]-methyl-amino]acetonitrile Formula: C9H12N6O2 MolecularWeight: 236.23058

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C(=NC=N1)N(C)CC#N)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C(=NC=N1)N(C)CC#N)[N+](=O)[O-]

InChI

InChI=1S/C9H12N6O2/c1-13(2)8-7(15(16)17)9(12-6-11-8)14(3)5-4-10/h6H,5H2,1-3H3