methyl (2S,3S,6R)-6-hexyl-4-oxidanylidene-2-propyl-oxane-3-carboxylate

Systemtic Name: methyl (2S,3S,6R)-6-hexyl-4-oxidanylidene-2-propyl-oxane-3-carboxylate Openeye Name: methyl (2S,3S,6R)-6-hexyl-4-oxo-2-propyl-tetrahydropyran-3-carboxylate CAS Name: (2S,3S,6R)-6-hexyl-4-oxo-2-propyl-3-oxanecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,6R)-6-hexyl-4-oxo-2-propyloxane-3-carboxylate Traditional Name: (2S,3S,6R)-6-hexyl-4-keto-2-propyl-tetrahydropyran-3-carboxylic acid methyl ester Formula: C16H28O4 MolecularWeight: 284.39112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC(=O)C(C(O1)CCC)C(=O)OC

Isomeric SMILES

CCCCCC[C@@H]1CC(=O)[C@H]([C@@H](O1)CCC)C(=O)OC

InChI

InChI=1S/C16H28O4/c1-4-6-7-8-10-12-11-13(17)15(16(18)19-3)14(20-12)9-5-2/h12,14-15H,4-11H2,1-3H3/t12-,14+,15-/m1/s1