methyl 4-(3-bromanyl-4-fluoranyl-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: methyl 4-(3-bromanyl-4-fluoranyl-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl 4-(3-bromo-4-fluoro-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-(3-bromo-4-fluorophenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(3-bromo-4-fluorophenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: 4-(3-bromo-4-fluoro-phenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C13H12BrFN2O3 MolecularWeight: 343.148383

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(NC(=O)NC1=C)C2=CC(=C(C=C2)F)Br

Isomeric SMILES

COC(=O)C1C(NC(=O)NC1=C)C2=CC(=C(C=C2)F)Br

InChI

InChI=1S/C13H12BrFN2O3/c1-6-10(12(18)20-2)11(17-13(19)16-6)7-3-4-9(15)8(14)5-7/h3-5,10-11H,1H2,2H3,(H2,16,17,19)