ethyl 5-[[2-[(2,5-dimethylphenyl)methyl]-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl]methyl]furan-2-carboxylate

Systemtic Name: ethyl 5-[[2-[(2,5-dimethylphenyl)methyl]-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl]methyl]furan-2-carboxylate Openeye Name: ethyl 5-[[2-[(2,5-dimethylphenyl)methyl]-4-hydroxy-6-oxo-1H-pyrimidin-5-yl]methyl]furan-2-carboxylate CAS Name: 5-[[2-[(2,5-dimethylphenyl)methyl]-4-hydroxy-6-oxo-1H-pyrimidin-5-yl]methyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-[(2,5-dimethylphenyl)methyl]-4-hydroxy-6-oxo-1H-pyrimidin-5-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[2-(2,5-dimethylbenzyl)-4-hydroxy-6-keto-1H-pyrimidin-5-yl]methyl]furan-2-carboxylic acid ethyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)CC2=C(N=C(NC2=O)CC3=C(C=CC(=C3)C)C)O

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)CC2=C(N=C(NC2=O)CC3=C(C=CC(=C3)C)C)O

InChI

InChI=1S/C21H22N2O5/c1-4-27-21(26)17-8-7-15(28-17)11-16-19(24)22-18(23-20(16)25)10-14-9-12(2)5-6-13(14)3/h5-9H,4,10-11H2,1-3H3,(H2,22,23,24,25)