tert-butyl (5S)-7-chloranyl-5-oxidanyl-3-oxidanylidene-heptanoate

Systemtic Name: tert-butyl (5S)-7-chloranyl-5-oxidanyl-3-oxidanylidene-heptanoate Openeye Name: tert-butyl (5S)-7-chloro-5-hydroxy-3-oxo-heptanoate CAS Name: (5S)-7-chloro-5-hydroxy-3-oxoheptanoic acid tert-butyl ester IUPAC Name: tert-butyl (5S)-7-chloro-5-hydroxy-3-oxoheptanoate Traditional Name: (5S)-7-chloro-5-hydroxy-3-keto-enanthic acid tert-butyl ester Formula: C11H19ClO4 MolecularWeight: 250.71916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(=O)CC(CCCl)O

Isomeric SMILES

CC(C)(C)OC(=O)CC(=O)C[C@@H](CCCl)O

InChI

InChI=1S/C11H19ClO4/c1-11(2,3)16-10(15)7-9(14)6-8(13)4-5-12/h8,13H,4-7H2,1-3H3/t8-/m1/s1