tert-butyl (3S,5S)-6,6-dimethyl-3,5-bis(oxidanyl)heptanoate

Systemtic Name: tert-butyl (3S,5S)-6,6-dimethyl-3,5-bis(oxidanyl)heptanoate Openeye Name: tert-butyl (3S,5S)-3,5-dihydroxy-6,6-dimethyl-heptanoate CAS Name: (3S,5S)-3,5-dihydroxy-6,6-dimethylheptanoic acid tert-butyl ester IUPAC Name: tert-butyl (3S,5S)-3,5-dihydroxy-6,6-dimethylheptanoate Traditional Name: (3S,5S)-3,5-dihydroxy-6,6-dimethyl-enanthic acid tert-butyl ester Formula: C13H26O4 MolecularWeight: 246.34314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H26O4/c1-12(2,3)10(15)7-9(14)8-11(16)17-13(4,5)6/h9-10,14-15H,7-8H2,1-6H3/t9-,10-/m0/s1