(2R,5R,6R)-2-tert-butyl-5-[(3S)-heptan-3-yl]-6-methyl-1,3-dioxan-4-one

Systemtic Name: (2R,5R,6R)-2-tert-butyl-5-[(3S)-heptan-3-yl]-6-methyl-1,3-dioxan-4-one Openeye Name: (2R,5R,6R)-2-tert-butyl-5-[(1S)-1-ethylpentyl]-6-methyl-1,3-dioxan-4-one CAS Name: (2R,5R,6R)-2-tert-butyl-5-[(3S)-heptan-3-yl]-6-methyl-1,3-dioxan-4-one IUPAC Name: (2R,5R,6R)-2-tert-butyl-5-[(3S)-heptan-3-yl]-6-methyl-1,3-dioxan-4-one Traditional Name: (2R,5R,6R)-2-tert-butyl-5-[(1S)-1-ethylpentyl]-6-methyl-1,3-dioxan-4-one Formula: C16H30O3 MolecularWeight: 270.4076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C1C(OC(OC1=O)C(C)(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H30O3/c1-7-9-10-12(8-2)13-11(3)18-15(16(4,5)6)19-14(13)17/h11-13,15H,7-10H2,1-6H3/t11-,12+,13+,15-/m1/s1