ethyl (4S)-6-[2-(3,4-dimethylphenoxy)ethanoyloxymethyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-6-[2-(3,4-dimethylphenoxy)ethanoyloxymethyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[[2-(3,4-dimethylphenoxy)acetyl]oxymethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[2-(3,4-dimethylphenoxy)-1-oxoethoxy]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[[2-(3,4-dimethylphenoxy)acetyl]oxymethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[[2-(3,4-dimethylphenoxy)acetyl]oxymethyl]-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H26N2O6 MolecularWeight: 390.43024

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)COC2=CC(=C(C=C2)C)C)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)COC(=O)COC2=CC(=C(C=C2)C)C)C(=O)OCC

InChI

InChI=1S/C20H26N2O6/c1-5-15-18(19(24)26-6-2)16(22-20(25)21-15)10-28-17(23)11-27-14-8-7-12(3)13(4)9-14/h7-9,15H,5-6,10-11H2,1-4H3,(H2,21,22,25)/t15-/m0/s1