diethyl 1,6-dimethyl-4-(3-nitrophenyl)-2-oxidanylidene-4H-pyrimidine-3,5-dicarboxylate

Systemtic Name: diethyl 1,6-dimethyl-4-(3-nitrophenyl)-2-oxidanylidene-4H-pyrimidine-3,5-dicarboxylate Openeye Name: diethyl 1,6-dimethyl-4-(3-nitrophenyl)-2-oxo-4H-pyrimidine-3,5-dicarboxylate CAS Name: 1,6-dimethyl-4-(3-nitrophenyl)-2-oxo-4H-pyrimidine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1,6-dimethyl-4-(3-nitrophenyl)-2-oxo-4H-pyrimidine-3,5-dicarboxylate Traditional Name: 2-keto-1,6-dimethyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylic acid diethyl ester Formula: C18H21N3O7 MolecularWeight: 391.37524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)N(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)N(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)C)C

InChI

InChI=1S/C18H21N3O7/c1-5-27-16(22)14-11(3)19(4)17(23)20(18(24)28-6-2)15(14)12-8-7-9-13(10-12)21(25)26/h7-10,15H,5-6H2,1-4H3