2-(3-nitrophenyl)-4-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methoxy]pyrimidine

Systemtic Name: 2-(3-nitrophenyl)-4-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methoxy]pyrimidine Openeye Name: 4-isopropyl-2-(3-nitrophenyl)-6-[[4-(trifluoromethyl)phenyl]methoxy]pyrimidine CAS Name: 2-(3-nitrophenyl)-4-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methoxy]pyrimidine IUPAC Name: 2-(3-nitrophenyl)-4-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methoxy]pyrimidine Traditional Name: 4-isopropyl-2-(3-nitrophenyl)-6-[4-(trifluoromethyl)benzyl]oxy-pyrimidine Formula: C21H18F3N3O3 MolecularWeight: 417.38113

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NC(=N1)C2=CC(=CC=C2)[N+](=O)[O-])OCC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC(=NC(=N1)C2=CC(=CC=C2)[N+](=O)[O-])OCC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H18F3N3O3/c1-13(2)18-11-19(30-12-14-6-8-16(9-7-14)21(22,23)24)26-20(25-18)15-4-3-5-17(10-15)27(28)29/h3-11,13H,12H2,1-2H3