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

Systemtic Name: ethyl 6-[(2-fluoranyl-4-nitro-phenoxy)methyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(2-fluoro-4-nitro-phenoxy)methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(2-fluoro-4-nitrophenoxy)methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(2-fluoro-4-nitrophenoxy)methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(2-fluoro-4-nitro-phenoxy)methyl]-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H18FN3O6 MolecularWeight: 415.371823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18FN3O6/c1-2-29-19(25)17-15(11-30-16-9-8-13(24(27)28)10-14(16)21)22-20(26)23-18(17)12-6-4-3-5-7-12/h3-10,18H,2,11H2,1H3,(H2,22,23,26)