ethyl 4-[(E)-2-(3-nitrophenyl)ethenyl]-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(E)-2-(3-nitrophenyl)ethenyl]-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[(E)-2-(3-nitrophenyl)vinyl]-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-[(E)-2-(3-nitrophenyl)ethenyl]-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-2-(3-nitrophenyl)ethenyl]-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-[(E)-2-(3-nitrophenyl)vinyl]-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H17N3O4 MolecularWeight: 375.37738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1C=CC2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H17N3O4/c1-2-28-21(25)18-14-22-20(16-8-4-3-5-9-16)23-19(18)12-11-15-7-6-10-17(13-15)24(26)27/h3-14H,2H2,1H3/b12-11+