O5-ethyl O3-methyl 6-chloranyl-2-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylate

Systemtic Name: O5-ethyl O3-methyl 6-chloranyl-2-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylate Openeye Name: O5-ethyl O3-methyl 6-chloro-2-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylate CAS Name: 6-chloro-2-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester IUPAC Name: 5-O-ethyl 3-O-methyl 6-chloro-2-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylate Traditional Name: 6-chloro-2-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester Formula: C16H16ClN3O6 MolecularWeight: 381.76774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C)Cl

Isomeric SMILES

CCOC(=O)C1=C(N=C(N(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C)Cl

InChI

InChI=1S/C16H16ClN3O6/c1-4-26-15(21)12-13(10-6-5-7-11(8-10)20(23)24)19(16(22)25-3)9(2)18-14(12)17/h5-8,13H,4H2,1-3H3