5-[2-(trifluoromethyl)phenyl]-1,5,7,8,9,10-hexahydropyrimido[4,5-b]quinoline-2,4,6-trione

Systemtic Name: 5-[2-(trifluoromethyl)phenyl]-1,5,7,8,9,10-hexahydropyrimido[4,5-b]quinoline-2,4,6-trione Openeye Name: 5-[2-(trifluoromethyl)phenyl]-1,5,7,8,9,10-hexahydropyrimido[4,5-b]quinoline-2,4,6-trione CAS Name: 5-[2-(trifluoromethyl)phenyl]-1,5,7,8,9,10-hexahydropyrimido[4,5-b]quinoline-2,4,6-trione IUPAC Name: 5-[2-(trifluoromethyl)phenyl]-1,5,7,8,9,10-hexahydropyrimido[4,5-b]quinoline-2,4,6-trione Traditional Name: 5-[2-(trifluoromethyl)phenyl]-1,5,7,8,9,10-hexahydropyrimido[4,5-b]quinoline-2,4,6-trione Formula: C18H14F3N3O3 MolecularWeight: 377.31727

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C3=C(N2)NC(=O)NC3=O)C4=CC=CC=C4C(F)(F)F)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C3=C(N2)NC(=O)NC3=O)C4=CC=CC=C4C(F)(F)F)C(=O)C1

InChI

InChI=1S/C18H14F3N3O3/c19-18(20,21)9-5-2-1-4-8(9)12-13-10(6-3-7-11(13)25)22-15-14(12)16(26)24-17(27)23-15/h1-2,4-5,12H,3,6-7H2,(H3,22,23,24,26,27)