ethyl 6-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(3-bromo-4-ethoxy-5-methoxy-benzoyl)oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(3-bromo-4-ethoxy-5-methoxyphenyl)-oxomethoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(3-bromo-4-ethoxy-5-methoxybenzoyl)oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(3-bromo-4-ethoxy-5-methoxy-benzoyl)oxymethyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H21BrN2O7 MolecularWeight: 457.27254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)OCC2=C(CNC(=O)N2)C(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)OCC2=C(CNC(=O)N2)C(=O)OCC)OC

InChI

InChI=1S/C18H21BrN2O7/c1-4-26-15-12(19)6-10(7-14(15)25-3)16(22)28-9-13-11(17(23)27-5-2)8-20-18(24)21-13/h6-7H,4-5,8-9H2,1-3H3,(H2,20,21,24)