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

Systemtic Name: ethyl (4R)-6-[4-(4-bromanylphenoxy)butanoyloxymethyl]-4-(furan-2-yl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-6-[4-(4-bromophenoxy)butanoyloxymethyl]-4-(2-furyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-[[4-(4-bromophenoxy)-1-oxobutoxy]methyl]-4-(2-furanyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-6-[4-(4-bromophenoxy)butanoyloxymethyl]-4-(furan-2-yl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-[4-(4-bromophenoxy)butanoyloxymethyl]-4-(2-furyl)-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H23BrN2O7 MolecularWeight: 507.33122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CO2)COC(=O)CCCOC3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC=CO2)COC(=O)CCCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H23BrN2O7/c1-2-29-21(27)19-16(24-22(28)25-20(19)17-5-3-12-31-17)13-32-18(26)6-4-11-30-15-9-7-14(23)8-10-15/h3,5,7-10,12,20H,2,4,6,11,13H2,1H3,(H2,24,25,28)/t20-/m0/s1