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

Systemtic Name: dimethyl 5-[(6-ethoxy-5-nitro-pyrimidin-4-yl)amino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(6-ethoxy-5-nitro-pyrimidin-4-yl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[(6-ethoxy-5-nitro-4-pyrimidinyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(6-ethoxy-5-nitropyrimidin-4-yl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(6-ethoxy-5-nitro-pyrimidin-4-yl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C16H16N4O7 MolecularWeight: 376.32084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=NC(=C1[N+](=O)[O-])NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCOC1=NC=NC(=C1[N+](=O)[O-])NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C16H16N4O7/c1-4-27-14-12(20(23)24)13(17-8-18-14)19-11-6-9(15(21)25-2)5-10(7-11)16(22)26-3/h5-8H,4H2,1-3H3,(H,17,18,19)