ethyl 4-(2-ethoxy-5-nitro-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: ethyl 4-(2-ethoxy-5-nitro-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: ethyl 4-(2-ethoxy-5-nitro-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-(2-ethoxy-5-nitrophenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-ethoxy-5-nitrophenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: 4-(2-ethoxy-5-nitro-phenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid ethyl ester Formula: C16H19N3O6 MolecularWeight: 349.33856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)[N+](=O)[O-])C2C(C(=C)NC(=O)N2)C(=O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[N+](=O)[O-])C2C(C(=C)NC(=O)N2)C(=O)OCC

InChI

InChI=1S/C16H19N3O6/c1-4-24-12-7-6-10(19(22)23)8-11(12)14-13(15(20)25-5-2)9(3)17-16(21)18-14/h6-8,13-14H,3-5H2,1-2H3,(H2,17,18,21)