ethyl 1-ethanoyl-4-methylidene-6-(4-nitrophenyl)-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: ethyl 1-ethanoyl-4-methylidene-6-(4-nitrophenyl)-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: ethyl 1-acetyl-4-methylene-6-(4-nitrophenyl)-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: 1-acetyl-4-methylene-6-(4-nitrophenyl)-2-oxo-1,3-diazinane-5-carboxylic acid ethyl ester IUPAC Name: ethyl 1-acetyl-4-methylidene-6-(4-nitrophenyl)-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: 1-acetyl-2-keto-4-methylene-6-(4-nitrophenyl)hexahydropyrimidine-5-carboxylic acid ethyl ester Formula: C16H17N3O6 MolecularWeight: 347.32268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N(C(=O)NC1=C)C(=O)C)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1C(N(C(=O)NC1=C)C(=O)C)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O6/c1-4-25-15(21)13-9(2)17-16(22)18(10(3)20)14(13)11-5-7-12(8-6-11)19(23)24/h5-8,13-14H,2,4H2,1,3H3,(H,17,22)