tert-butyl 3-(4-fluorophenyl)-3-oxidanyl-4-(1,2,4-triazol-1-yl)butanoate

Systemtic Name: tert-butyl 3-(4-fluorophenyl)-3-oxidanyl-4-(1,2,4-triazol-1-yl)butanoate Openeye Name: tert-butyl 3-(4-fluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butanoate CAS Name: 3-(4-fluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-fluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butanoate Traditional Name: 3-(4-fluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butyric acid tert-butyl ester Formula: C16H20FN3O3 MolecularWeight: 321.346703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CN1C=NC=N1)(C2=CC=C(C=C2)F)O

Isomeric SMILES

CC(C)(C)OC(=O)CC(CN1C=NC=N1)(C2=CC=C(C=C2)F)O

InChI

InChI=1S/C16H20FN3O3/c1-15(2,3)23-14(21)8-16(22,9-20-11-18-10-19-20)12-4-6-13(17)7-5-12/h4-7,10-11,22H,8-9H2,1-3H3