dimethyl 5-[(6-diazanyl-5-nitro-pyrimidin-4-yl)amino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(6-diazanyl-5-nitro-pyrimidin-4-yl)amino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(6-hydrazino-5-nitro-pyrimidin-4-yl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[(6-hydrazinyl-5-nitro-4-pyrimidinyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(6-hydrazinyl-5-nitropyrimidin-4-yl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(6-hydrazino-5-nitro-pyrimidin-4-yl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C14H14N6O6 MolecularWeight: 362.29756

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC2=C(C(=NC=N2)NN)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC2=C(C(=NC=N2)NN)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C14H14N6O6/c1-25-13(21)7-3-8(14(22)26-2)5-9(4-7)18-11-10(20(23)24)12(19-15)17-6-16-11/h3-6H,15H2,1-2H3,(H2,16,17,18,19)