3-ethanoyl-6-methyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrimidin-2-one

Systemtic Name: 3-ethanoyl-6-methyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrimidin-2-one Openeye Name: 3-acetyl-6-methyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrimidin-2-one CAS Name: 3-acetyl-6-methyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrimidin-2-one IUPAC Name: 3-acetyl-6-methyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrimidin-2-one Traditional Name: 3-acetyl-6-methyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyrimidin-2-one Formula: C14H12F3N3O4 MolecularWeight: 343.25799

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)C(=O)C)C2=CC=CC=C2C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(N(C(=O)N1)C(=O)C)C2=CC=CC=C2C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H12F3N3O4/c1-7-11(20(23)24)12(19(8(2)21)13(22)18-7)9-5-3-4-6-10(9)14(15,16)17/h3-6,12H,1-2H3,(H,18,22)