[4-chloranyl-2-[[2-oxidanylidene-5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-3-yl]methyl]phenyl]methyl dihydrogen phosphate

Systemtic Name: [4-chloranyl-2-[[2-oxidanylidene-5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-3-yl]methyl]phenyl]methyl dihydrogen phosphate Openeye Name: [4-chloro-2-[[2-oxo-5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-3-yl]methyl]phenyl]methyl dihydrogen phosphate CAS Name: [4-chloro-2-[[2-oxo-5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-3-yl]methyl]phenyl]methyl dihydrogen phosphate IUPAC Name: [4-chloro-2-[[2-oxo-5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-3-yl]methyl]phenyl]methyl dihydrogen phosphate Traditional Name: [4-chloro-2-[[2-keto-5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-3-yl]methyl]benzyl] dihydrogen phosphate Formula: C17H13ClF3N2O6P MolecularWeight: 464.716891

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C(=O)O2)CC3=C(C=CC(=C3)Cl)COP(=O)(O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C(=O)O2)CC3=C(C=CC(=C3)Cl)COP(=O)(O)O)C(F)(F)F

InChI

InChI=1S/C17H13ClF3N2O6P/c18-14-6-3-11(9-28-30(25,26)27)12(7-14)8-23-16(24)29-15(22-23)10-1-4-13(5-2-10)17(19,20)21/h1-7H,8-9H2,(H2,25,26,27)