(2,6-dimethylphenyl) (2S)-2-[(4S,5R,6S)-2,2,5-trimethyl-6-[(2R)-1-oxidanylpropan-2-yl]-1,3-dioxan-4-yl]propanoate

Systemtic Name: (2,6-dimethylphenyl) (2S)-2-[(4S,5R,6S)-2,2,5-trimethyl-6-[(2R)-1-oxidanylpropan-2-yl]-1,3-dioxan-4-yl]propanoate Openeye Name: (2,6-dimethylphenyl) (2S)-2-[(4S,5R,6S)-6-[(1R)-2-hydroxy-1-methyl-ethyl]-2,2,5-trimethyl-1,3-dioxan-4-yl]propanoate CAS Name: (2S)-2-[(4S,5R,6S)-6-[(2R)-1-hydroxypropan-2-yl]-2,2,5-trimethyl-1,3-dioxan-4-yl]propanoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) (2S)-2-[(4S,5R,6S)-6-[(2R)-1-hydroxypropan-2-yl]-2,2,5-trimethyl-1,3-dioxan-4-yl]propanoate Traditional Name: (2S)-2-[(4S,5R,6S)-6-[(1R)-2-hydroxy-1-methyl-ethyl]-2,2,5-trimethyl-1,3-dioxan-4-yl]propionic acid (2,6-dimethylphenyl) ester Formula: C21H32O5 MolecularWeight: 364.47578

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(OC1C(C)C(=O)OC2=C(C=CC=C2C)C)(C)C)C(C)CO

Isomeric SMILES

C[C@@H]1[C@@H](OC(O[C@@H]1[C@H](C)C(=O)OC2=C(C=CC=C2C)C)(C)C)[C@H](C)CO

InChI

InChI=1S/C21H32O5/c1-12-9-8-10-13(2)17(12)24-20(23)16(5)19-15(4)18(14(3)11-22)25-21(6,7)26-19/h8-10,14-16,18-19,22H,11H2,1-7H3/t14-,15-,16+,18+,19+/m1/s1