ethyl (4R)-6-[[4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoyl]oxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R)-6-[[4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoyl]oxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-6-[[4-(2,5-dimethylphenyl)-4-oxo-butanoyl]oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-[[4-(2,5-dimethylphenyl)-1,4-dioxobutoxy]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-6-[[4-(2,5-dimethylphenyl)-4-oxobutanoyl]oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-[[4-(2,5-dimethylphenyl)-4-keto-butanoyl]oxymethyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)CCC(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C)COC(=O)CCC(=O)C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C21H26N2O6/c1-5-28-20(26)19-14(4)22-21(27)23-16(19)11-29-18(25)9-8-17(24)15-10-12(2)6-7-13(15)3/h6-7,10,14H,5,8-9,11H2,1-4H3,(H2,22,23,27)/t14-/m1/s1