diethyl 2-[[(6-nitroquinazolin-4-yl)amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(6-nitroquinazolin-4-yl)amino]methylidene]propanedioate Openeye Name: diethyl 2-[[(6-nitroquinazolin-4-yl)amino]methylene]propanedioate CAS Name: 2-[[(6-nitro-4-quinazolinyl)amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(6-nitroquinazolin-4-yl)amino]methylidene]propanedioate Traditional Name: 2-[[(6-nitroquinazolin-4-yl)amino]methylene]malonic acid diethyl ester Formula: C16H16N4O6 MolecularWeight: 360.32144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NC=NC2=C1C=C(C=C2)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=NC=NC2=C1C=C(C=C2)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C16H16N4O6/c1-3-25-15(21)12(16(22)26-4-2)8-17-14-11-7-10(20(23)24)5-6-13(11)18-9-19-14/h5-9H,3-4H2,1-2H3,(H,17,18,19)