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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC(=C(C(=C2)Br)O)OCC)C(=O)OC)C

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC(=C(C(=C2)Br)O)OCC)C(=O)OC)C

InChI

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