ethyl 4-(3-nitrophenyl)carbonyl-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(3-nitrophenyl)carbonyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(3-nitrobenzoyl)-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-[(3-nitrophenyl)-oxomethyl]-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-nitrobenzoyl)-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-(3-nitrobenzoyl)-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H15N3O5 MolecularWeight: 377.3502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15N3O5/c1-2-28-20(25)16-12-21-19(13-7-4-3-5-8-13)22-17(16)18(24)14-9-6-10-15(11-14)23(26)27/h3-12H,2H2,1H3