5-(5-chloranyl-2-methoxy-phenyl)-2-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-one

Systemtic Name: 5-(5-chloranyl-2-methoxy-phenyl)-2-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-one Openeye Name: 5-(5-chloro-2-methoxy-phenyl)-2-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-one CAS Name: 5-(5-chloro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-one IUPAC Name: 5-(5-chloro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-one Traditional Name: 5-(5-chloro-2-methoxy-phenyl)-2-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-one Formula: C16H11ClF3N3O2 MolecularWeight: 369.72565

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=NC(=O)N(N2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=NC(=O)N(N2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H11ClF3N3O2/c1-25-13-7-4-10(17)8-12(13)14-21-15(24)23(22-14)11-5-2-9(3-6-11)16(18,19)20/h2-8H,1H3,(H,21,22,24)