1,3-dimethyl-6-[4-(5-nitropyridin-1-ium-2-yl)piperazin-1-yl]pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-6-[4-(5-nitropyridin-1-ium-2-yl)piperazin-1-yl]pyrimidine-2,4-dione Openeye Name: 1,3-dimethyl-6-[4-(5-nitropyridin-1-ium-2-yl)piperazin-1-yl]pyrimidine-2,4-dione CAS Name: 1,3-dimethyl-6-[4-(5-nitro-2-pyridin-1-iumyl)-1-piperazinyl]pyrimidine-2,4-dione IUPAC Name: 1,3-dimethyl-6-[4-(5-nitropyridin-1-ium-2-yl)piperazin-1-yl]pyrimidine-2,4-dione Traditional Name: 1,3-dimethyl-6-[4-(5-nitropyridin-1-ium-2-yl)piperazino]pyrimidine-2,4-quinone Formula: C15H19N6O4+ MolecularWeight: 347.34916

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)N2CCN(CC2)C3=[NH+]C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)N2CCN(CC2)C3=[NH+]C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H18N6O4/c1-17-13(9-14(22)18(2)15(17)23)20-7-5-19(6-8-20)12-4-3-11(10-16-12)21(24)25/h3-4,9-10H,5-8H2,1-2H3/p+1