ethyl 4-[6-chloranyl-4-methyl-1-(3-nitrophenyl)-2H-pyridin-5-yl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[6-chloranyl-4-methyl-1-(3-nitrophenyl)-2H-pyridin-5-yl]pyrimidine-5-carboxylate Openeye Name: ethyl 4-[6-chloro-4-methyl-1-(3-nitrophenyl)-2H-pyridin-5-yl]pyrimidine-5-carboxylate CAS Name: 4-[6-chloro-4-methyl-1-(3-nitrophenyl)-2H-pyridin-5-yl]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-chloro-4-methyl-1-(3-nitrophenyl)-2H-pyridin-5-yl]pyrimidine-5-carboxylate Traditional Name: 4-[6-chloro-4-methyl-1-(3-nitrophenyl)-2H-pyridin-5-yl]pyrimidine-5-carboxylic acid ethyl ester Formula: C19H17ClN4O4 MolecularWeight: 400.81568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=CN=C1C2=C(N(CC=C2C)C3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)C1=CN=CN=C1C2=C(N(CC=C2C)C3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H17ClN4O4/c1-3-28-19(25)15-10-21-11-22-17(15)16-12(2)7-8-23(18(16)20)13-5-4-6-14(9-13)24(26)27/h4-7,9-11H,3,8H2,1-2H3