(2,6-ditert-butyl-4-methyl-phenyl) (2S,3S,4S)-2,4-dimethyl-3-oxidanyl-heptanoate

Systemtic Name: (2,6-ditert-butyl-4-methyl-phenyl) (2S,3S,4S)-2,4-dimethyl-3-oxidanyl-heptanoate Openeye Name: (2,6-ditert-butyl-4-methyl-phenyl) (2S,3S,4S)-3-hydroxy-2,4-dimethyl-heptanoate CAS Name: (2S,3S,4S)-3-hydroxy-2,4-dimethylheptanoic acid (2,6-ditert-butyl-4-methylphenyl) ester IUPAC Name: (2,6-ditert-butyl-4-methylphenyl) (2S,3S,4S)-3-hydroxy-2,4-dimethylheptanoate Traditional Name: (2S,3S,4S)-3-hydroxy-2,4-dimethyl-enanthic acid (2,6-ditert-butyl-4-methyl-phenyl) ester Formula: C24H40O3 MolecularWeight: 376.5726

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(C(C)C(=O)OC1=C(C=C(C=C1C(C)(C)C)C)C(C)(C)C)O

Isomeric SMILES

CCC[C@H](C)[C@@H]([C@H](C)C(=O)OC1=C(C=C(C=C1C(C)(C)C)C)C(C)(C)C)O

InChI

InChI=1S/C24H40O3/c1-11-12-16(3)20(25)17(4)22(26)27-21-18(23(5,6)7)13-15(2)14-19(21)24(8,9)10/h13-14,16-17,20,25H,11-12H2,1-10H3/t16-,17-,20-/m0/s1