ethyl 4-(2-chloranyl-3-nitro-phenyl)-6-methyl-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(2-chloranyl-3-nitro-phenyl)-6-methyl-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-(2-chloro-3-nitro-phenyl)-6-methyl-2-(2-pyridyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(2-chloro-3-nitrophenyl)-6-methyl-2-(2-pyridinyl)-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chloro-3-nitrophenyl)-6-methyl-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(2-chloro-3-nitro-phenyl)-6-methyl-2-(2-pyridyl)-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C19H17ClN4O4 MolecularWeight: 400.81568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=NC1C2=C(C(=CC=C2)[N+](=O)[O-])Cl)C3=CC=CC=N3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=NC1C2=C(C(=CC=C2)[N+](=O)[O-])Cl)C3=CC=CC=N3)C

InChI

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