ethyl 4-(3-bromanyl-2-chloranyl-5-ethoxy-4-oxidanyl-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(3-bromanyl-2-chloranyl-5-ethoxy-4-oxidanyl-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(3-bromo-2-chloro-5-ethoxy-4-hydroxy-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(3-bromo-2-chloro-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-bromo-2-chloro-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(3-bromo-2-chloro-5-ethoxy-4-hydroxy-phenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C16H18BrClN2O5 MolecularWeight: 433.68152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C(=C1)C2C(=C(NC(=O)N2)C)C(=O)OCC)Cl)Br)O

Isomeric SMILES

CCOC1=C(C(=C(C(=C1)C2C(=C(NC(=O)N2)C)C(=O)OCC)Cl)Br)O

InChI

InChI=1S/C16H18BrClN2O5/c1-4-24-9-6-8(12(18)11(17)14(9)21)13-10(15(22)25-5-2)7(3)19-16(23)20-13/h6,13,21H,4-5H2,1-3H3,(H2,19,20,23)