ethyl (5S)-2-ethanoyl-5-[(2R,4S,5R)-5-methyl-2-phenyl-1,3-dioxan-4-yl]hexanoate

Systemtic Name: ethyl (5S)-2-ethanoyl-5-[(2R,4S,5R)-5-methyl-2-phenyl-1,3-dioxan-4-yl]hexanoate Openeye Name: ethyl (5S)-2-acetyl-5-[(2R,4S,5R)-5-methyl-2-phenyl-1,3-dioxan-4-yl]hexanoate CAS Name: (5S)-2-acetyl-5-[(2R,4S,5R)-5-methyl-2-phenyl-1,3-dioxan-4-yl]hexanoic acid ethyl ester IUPAC Name: ethyl (5S)-2-acetyl-5-[(2R,4S,5R)-5-methyl-2-phenyl-1,3-dioxan-4-yl]hexanoate Traditional Name: (5S)-2-acetyl-5-[(2R,4S,5R)-5-methyl-2-phenyl-1,3-dioxan-4-yl]hexanoic acid ethyl ester Formula: C21H30O5 MolecularWeight: 362.4599

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(C)C1C(COC(O1)C2=CC=CC=C2)C)C(=O)C

Isomeric SMILES

CCOC(=O)C(CC[C@H](C)[C@H]1[C@@H](CO[C@H](O1)C2=CC=CC=C2)C)C(=O)C

InChI

InChI=1S/C21H30O5/c1-5-24-20(23)18(16(4)22)12-11-14(2)19-15(3)13-25-21(26-19)17-9-7-6-8-10-17/h6-10,14-15,18-19,21H,5,11-13H2,1-4H3/t14-,15+,18?,19-,21+/m0/s1