ethyl 4-(4-chlorophenyl)-6-[(5-fluoranyl-2-nitro-phenoxy)methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-6-[(5-fluoranyl-2-nitro-phenoxy)methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-6-[(5-fluoro-2-nitro-phenoxy)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(4-chlorophenyl)-6-[(5-fluoro-2-nitrophenoxy)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-6-[(5-fluoro-2-nitrophenoxy)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(4-chlorophenyl)-6-[(5-fluoro-2-nitro-phenoxy)methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H17ClFN3O6 MolecularWeight: 449.816883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)Cl)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)Cl)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H17ClFN3O6/c1-2-30-19(26)17-14(10-31-16-9-13(22)7-8-15(16)25(28)29)23-20(27)24-18(17)11-3-5-12(21)6-4-11/h3-9,18H,2,10H2,1H3,(H2,23,24,27)