3-(oxolan-2-ylmethyl)-4-phenyl-6,6-bis(trifluoromethyl)-1H-1,3,5-triazin-2-one

Systemtic Name: 3-(oxolan-2-ylmethyl)-4-phenyl-6,6-bis(trifluoromethyl)-1H-1,3,5-triazin-2-one Openeye Name: 4-phenyl-3-(tetrahydrofuran-2-ylmethyl)-6,6-bis(trifluoromethyl)-1H-1,3,5-triazin-2-one CAS Name: 3-(2-oxolanylmethyl)-4-phenyl-6,6-bis(trifluoromethyl)-1H-1,3,5-triazin-2-one IUPAC Name: 3-(oxolan-2-ylmethyl)-4-phenyl-6,6-bis(trifluoromethyl)-1H-1,3,5-triazin-2-one Traditional Name: 4-phenyl-3-(tetrahydrofurfuryl)-6,6-bis(trifluoromethyl)-1H-s-triazin-2-one Formula: C16H15F6N3O2 MolecularWeight: 395.299619

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=NC(NC2=O)(C(F)(F)F)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

C1CC(OC1)CN2C(=NC(NC2=O)(C(F)(F)F)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C16H15F6N3O2/c17-15(18,19)14(16(20,21)22)23-12(10-5-2-1-3-6-10)25(13(26)24-14)9-11-7-4-8-27-11/h1-3,5-6,11H,4,7-9H2,(H,24,26)