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

Systemtic Name: ethyl (4S)-4-ethyl-6-[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-6-[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-ethyl-6-[[2-(5-methyl-2-propan-2-ylphenoxy)-1-oxoethoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-ethyl-6-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-6-[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]oxymethyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H30N2O6 MolecularWeight: 418.4834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O6/c1-6-16-20(21(26)28-7-2)17(24-22(27)23-16)11-30-19(25)12-29-18-10-14(5)8-9-15(18)13(3)4/h8-10,13,16H,6-7,11-12H2,1-5H3,(H2,23,24,27)/t16-/m0/s1