ethyl 1-(2,2-diethoxyethyl)-2-(4-nitrophenyl)-6-oxidanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-(2,2-diethoxyethyl)-2-(4-nitrophenyl)-6-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 1-(2,2-diethoxyethyl)-2-(4-nitrophenyl)-6-oxo-pyrimidine-5-carboxylate CAS Name: 1-(2,2-diethoxyethyl)-2-(4-nitrophenyl)-6-oxo-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2,2-diethoxyethyl)-2-(4-nitrophenyl)-6-oxopyrimidine-5-carboxylate Traditional Name: 1-(2,2-diethoxyethyl)-6-keto-2-(4-nitrophenyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C19H23N3O7 MolecularWeight: 405.40182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN1C(=NC=C(C1=O)C(=O)OCC)C2=CC=C(C=C2)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC(CN1C(=NC=C(C1=O)C(=O)OCC)C2=CC=C(C=C2)[N+](=O)[O-])OCC

InChI

InChI=1S/C19H23N3O7/c1-4-27-16(28-5-2)12-21-17(13-7-9-14(10-8-13)22(25)26)20-11-15(18(21)23)19(24)29-6-3/h7-11,16H,4-6,12H2,1-3H3