ethyl (6R)-6-(2-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl (6R)-6-(2-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6R)-6-(2-bromo-5-ethoxy-4-hydroxy-phenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-(2-bromo-5-ethoxy-4-hydroxyphenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6R)-6-(2-bromo-5-ethoxy-4-hydroxyphenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-(2-bromo-5-ethoxy-4-hydroxy-phenyl)-2-keto-3,4-dimethyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C17H21BrN2O5 MolecularWeight: 413.26304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C2C(=C(N(C(=O)N2)C)C)C(=O)OCC)Br)O

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[C@H]2C(=C(N(C(=O)N2)C)C)C(=O)OCC)Br)O

InChI

InChI=1S/C17H21BrN2O5/c1-5-24-13-7-10(11(18)8-12(13)21)15-14(16(22)25-6-2)9(3)20(4)17(23)19-15/h7-8,15,21H,5-6H2,1-4H3,(H,19,23)/t15-/m0/s1