methyl (4R,5S)-4-(2-bromanyl-4-methoxy-3-oxidanyl-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: methyl (4R,5S)-4-(2-bromanyl-4-methoxy-3-oxidanyl-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl (4R,5S)-4-(2-bromo-3-hydroxy-4-methoxy-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4R,5S)-4-(2-bromo-3-hydroxy-4-methoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl (4R,5S)-4-(2-bromo-3-hydroxy-4-methoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4R,5S)-4-(2-bromo-3-hydroxy-4-methoxy-phenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C14H15BrN2O5 MolecularWeight: 371.1833

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2C(C(=C)NC(=O)N2)C(=O)OC)Br)O

Isomeric SMILES

COC1=C(C(=C(C=C1)[C@H]2[C@@H](C(=C)NC(=O)N2)C(=O)OC)Br)O

InChI

InChI=1S/C14H15BrN2O5/c1-6-9(13(19)22-3)11(17-14(20)16-6)7-4-5-8(21-2)12(18)10(7)15/h4-5,9,11,18H,1H2,2-3H3,(H2,16,17,20)/t9-,11+/m1/s1