(4-nitrophenyl) 5-ethanoyl-2-methoxy-6-methyl-4-phenyl-4H-pyrimidine-3-carboxylate

Systemtic Name: (4-nitrophenyl) 5-ethanoyl-2-methoxy-6-methyl-4-phenyl-4H-pyrimidine-3-carboxylate Openeye Name: (4-nitrophenyl) 5-acetyl-2-methoxy-6-methyl-4-phenyl-4H-pyrimidine-3-carboxylate CAS Name: 5-acetyl-2-methoxy-6-methyl-4-phenyl-4H-pyrimidine-3-carboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 5-acetyl-2-methoxy-6-methyl-4-phenyl-4H-pyrimidine-3-carboxylate Traditional Name: 5-acetyl-2-methoxy-6-methyl-4-phenyl-4H-pyrimidine-3-carboxylic acid (4-nitrophenyl) ester Formula: C21H19N3O6 MolecularWeight: 409.39206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=N1)OC)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC1=C(C(N(C(=N1)OC)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C21H19N3O6/c1-13-18(14(2)25)19(15-7-5-4-6-8-15)23(20(22-13)29-3)21(26)30-17-11-9-16(10-12-17)24(27)28/h4-12,19H,1-3H3