methyl 3-[(2R,3S,6R)-6-acetyloxy-3,7,7-trimethyl-3-oxidanyl-oxepan-2-yl]propanoate

Systemtic Name: methyl 3-[(2R,3S,6R)-6-acetyloxy-3,7,7-trimethyl-3-oxidanyl-oxepan-2-yl]propanoate Openeye Name: methyl 3-[(2R,3S,6R)-6-acetoxy-3-hydroxy-3,7,7-trimethyl-oxepan-2-yl]propanoate CAS Name: 3-[(2R,3S,6R)-6-acetyloxy-3-hydroxy-3,7,7-trimethyl-2-oxepanyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(2R,3S,6R)-6-acetyloxy-3-hydroxy-3,7,7-trimethyloxepan-2-yl]propanoate Traditional Name: 3-[(2R,3S,6R)-6-acetoxy-3-hydroxy-3,7,7-trimethyl-oxepan-2-yl]propionic acid methyl ester Formula: C15H26O6 MolecularWeight: 302.36334

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC(C(OC1(C)C)CCC(=O)OC)(C)O

Isomeric SMILES

CC(=O)O[C@@H]1CC[C@]([C@H](OC1(C)C)CCC(=O)OC)(C)O

InChI

InChI=1S/C15H26O6/c1-10(16)20-11-8-9-15(4,18)12(21-14(11,2)3)6-7-13(17)19-5/h11-12,18H,6-9H2,1-5H3/t11-,12-,15+/m1/s1