6-(2,2-diethoxyethylamino)-2-(dimethylamino)-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 6-(2,2-diethoxyethylamino)-2-(dimethylamino)-5-nitro-1H-pyrimidin-4-one Openeye Name: 6-(2,2-diethoxyethylamino)-2-(dimethylamino)-5-nitro-1H-pyrimidin-4-one CAS Name: 6-(2,2-diethoxyethylamino)-2-(dimethylamino)-5-nitro-1H-pyrimidin-4-one IUPAC Name: 6-(2,2-diethoxyethylamino)-2-(dimethylamino)-5-nitro-1H-pyrimidin-4-one Traditional Name: 6-(2,2-diethoxyethylamino)-2-(dimethylamino)-5-nitro-1H-pyrimidin-4-one Formula: C12H21N5O5 MolecularWeight: 315.32564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CNC1=C(C(=O)N=C(N1)N(C)C)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC(CNC1=C(C(=O)N=C(N1)N(C)C)[N+](=O)[O-])OCC

InChI

InChI=1S/C12H21N5O5/c1-5-21-8(22-6-2)7-13-10-9(17(19)20)11(18)15-12(14-10)16(3)4/h8H,5-7H2,1-4H3,(H2,13,14,15,18)