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

Systemtic Name: methyl 4-(4-chloranyl-2-fluoranyl-5-nitro-phenyl)-2-(3-fluoranylpyridin-2-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: methyl 4-(4-chloro-2-fluoro-5-nitro-phenyl)-2-(3-fluoro-2-pyridyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(4-chloro-2-fluoro-5-nitrophenyl)-2-(3-fluoro-2-pyridinyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-chloro-2-fluoro-5-nitrophenyl)-2-(3-fluoropyridin-2-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(4-chloro-2-fluoro-5-nitro-phenyl)-2-(3-fluoro-2-pyridyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C18H13ClF2N4O4 MolecularWeight: 422.770026

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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=C3F)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=C3F)Cl)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H13ClF2N4O4/c1-8-14(18(26)29-2)15(9-6-13(25(27)28)10(19)7-12(9)21)24-17(23-8)16-11(20)4-3-5-22-16/h3-7,15H,1-2H3,(H,23,24)