ethyl 4-methyl-6-(4-nitro-3-oxidanyl-phenyl)-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-methyl-6-(4-nitro-3-oxidanyl-phenyl)-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(3-hydroxy-4-nitro-phenyl)-6-methyl-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-(3-hydroxy-4-nitrophenyl)-6-methyl-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-hydroxy-4-nitrophenyl)-6-methyl-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-(3-hydroxy-4-nitro-phenyl)-6-methyl-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1C)C2=CC=CC=C2)C3=CC(=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1C)C2=CC=CC=C2)C3=CC(=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C20H17N3O5/c1-3-28-20(25)17-12(2)21-19(13-7-5-4-6-8-13)22-18(17)14-9-10-15(23(26)27)16(24)11-14/h4-11,24H,3H2,1-2H3