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

Systemtic Name: methyl 4-(4-chloranyl-3-nitro-phenyl)-2-(3-fluoranylpyridin-2-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: methyl 4-(4-chloro-3-nitro-phenyl)-2-(3-fluoro-2-pyridyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(4-chloro-3-nitrophenyl)-2-(3-fluoro-2-pyridinyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-chloro-3-nitrophenyl)-2-(3-fluoropyridin-2-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(4-chloro-3-nitro-phenyl)-2-(3-fluoro-2-pyridyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C18H14ClFN4O4 MolecularWeight: 404.779563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1)C2=C(C=CC=N2)F)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(N=C(N1)C2=C(C=CC=N2)F)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H14ClFN4O4/c1-9-14(18(25)28-2)15(10-5-6-11(19)13(8-10)24(26)27)23-17(22-9)16-12(20)4-3-7-21-16/h3-8,15H,1-2H3,(H,22,23)