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

Systemtic Name: methyl 4-methylidene-6-(2-nitrophenyl)-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl 4-methylene-6-(2-nitrophenyl)-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-methylene-6-(2-nitrophenyl)-2-oxo-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl 4-methylidene-6-(2-nitrophenyl)-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: 2-keto-4-methylene-6-(2-nitrophenyl)hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C13H13N3O5 MolecularWeight: 291.25942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N3O5/c1-7-10(12(17)21-2)11(15-13(18)14-7)8-5-3-4-6-9(8)16(19)20/h3-6,10-11H,1H2,2H3,(H2,14,15,18)