5-[1-(4-dimethylaminophenyl)-2-nitro-ethyl]-1,3-dimethyl-6-(oxidanylamino)pyrimidine-2,4-dione

Systemtic Name: 5-[1-(4-dimethylaminophenyl)-2-nitro-ethyl]-1,3-dimethyl-6-(oxidanylamino)pyrimidine-2,4-dione Openeye Name: 5-[1-(4-dimethylaminophenyl)-2-nitro-ethyl]-6-(hydroxyamino)-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 5-[1-(4-dimethylaminophenyl)-2-nitroethyl]-6-(hydroxyamino)-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 5-[1-(4-dimethylaminophenyl)-2-nitroethyl]-6-(hydroxyamino)-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 5-[1-(4-dimethylaminophenyl)-2-nitro-ethyl]-6-(hydroxyamino)-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C16H21N5O5 MolecularWeight: 363.36844

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C(C[N+](=O)[O-])C2=CC=C(C=C2)N(C)C)NO

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C(C[N+](=O)[O-])C2=CC=C(C=C2)N(C)C)NO

InChI

InChI=1S/C16H21N5O5/c1-18(2)11-7-5-10(6-8-11)12(9-21(25)26)13-14(17-24)19(3)16(23)20(4)15(13)22/h5-8,12,17,24H,9H2,1-4H3