ethyl 6-[4-(3-bromanylphenoxy)butanoyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[4-(3-bromanylphenoxy)butanoyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[4-(3-bromophenoxy)butanoyloxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[4-(3-bromophenoxy)-1-oxobutoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-(3-bromophenoxy)butanoyloxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[4-(3-bromophenoxy)butanoyloxymethyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H21BrN2O6 MolecularWeight: 441.27314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)CCCOC2=CC(=CC=C2)Br

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)CCCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C18H21BrN2O6/c1-2-25-17(23)14-10-20-18(24)21-15(14)11-27-16(22)7-4-8-26-13-6-3-5-12(19)9-13/h3,5-6,9H,2,4,7-8,10-11H2,1H3,(H2,20,21,24)