tert-butyl (4R,5R)-5-(2-chloranyl-6-fluoranyl-phenyl)-4-methyl-5-oxidanyl-3-oxidanylidene-pentanoate

Systemtic Name: tert-butyl (4R,5R)-5-(2-chloranyl-6-fluoranyl-phenyl)-4-methyl-5-oxidanyl-3-oxidanylidene-pentanoate Openeye Name: tert-butyl (4R,5R)-5-(2-chloro-6-fluoro-phenyl)-5-hydroxy-4-methyl-3-oxo-pentanoate CAS Name: (4R,5R)-5-(2-chloro-6-fluorophenyl)-5-hydroxy-4-methyl-3-oxopentanoic acid tert-butyl ester IUPAC Name: tert-butyl (4R,5R)-5-(2-chloro-6-fluorophenyl)-5-hydroxy-4-methyl-3-oxopentanoate Traditional Name: (4R,5R)-5-(2-chloro-6-fluoro-phenyl)-5-hydroxy-3-keto-4-methyl-valeric acid tert-butyl ester Formula: C16H20ClFO4 MolecularWeight: 330.779003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=C(C=CC=C1Cl)F)O)C(=O)CC(=O)OC(C)(C)C

Isomeric SMILES

C[C@H]([C@H](C1=C(C=CC=C1Cl)F)O)C(=O)CC(=O)OC(C)(C)C

InChI

InChI=1S/C16H20ClFO4/c1-9(12(19)8-13(20)22-16(2,3)4)15(21)14-10(17)6-5-7-11(14)18/h5-7,9,15,21H,8H2,1-4H3/t9-,15+/m0/s1