[1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-phenyl-1,2,3-triazol-4-yl]-[3-(2-chlorophenyl)-5-(hydroxymethyl)-1,2-oxazol-4-yl]methanone

Systemtic Name: [1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-phenyl-1,2,3-triazol-4-yl]-[3-(2-chlorophenyl)-5-(hydroxymethyl)-1,2-oxazol-4-yl]methanone Openeye Name: [1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-phenyl-triazol-4-yl]-[3-(2-chlorophenyl)-5-(hydroxymethyl)isoxazol-4-yl]methanone CAS Name: [1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-phenyl-4-triazolyl]-[3-(2-chlorophenyl)-5-(hydroxymethyl)-4-isoxazolyl]methanone IUPAC Name: [1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-phenyltriazol-4-yl]-[3-(2-chlorophenyl)-5-(hydroxymethyl)-1,2-oxazol-4-yl]methanone Traditional Name: [1-[3,5-bis(trifluoromethyl)benzyl]-5-phenyl-triazol-4-yl]-[3-(2-chlorophenyl)-5-methylol-isoxazol-4-yl]methanone Formula: C28H17ClF6N4O3 MolecularWeight: 606.902999

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NN2CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)C4=C(ON=C4C5=CC=CC=C5Cl)CO

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NN2CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)C4=C(ON=C4C5=CC=CC=C5Cl)CO

InChI

InChI=1S/C28H17ClF6N4O3/c29-20-9-5-4-8-19(20)23-22(21(14-40)42-37-23)26(41)24-25(16-6-2-1-3-7-16)39(38-36-24)13-15-10-17(27(30,31)32)12-18(11-15)28(33,34)35/h1-12,40H,13-14H2