ethyl 4-[(2S,4S,6S)-2-tert-butyl-6-hexyl-1,3-dioxan-4-yl]butanoate

Systemtic Name: ethyl 4-[(2S,4S,6S)-2-tert-butyl-6-hexyl-1,3-dioxan-4-yl]butanoate Openeye Name: ethyl 4-[(2S,4S,6S)-2-tert-butyl-6-hexyl-1,3-dioxan-4-yl]butanoate CAS Name: 4-[(2S,4S,6S)-2-tert-butyl-6-hexyl-1,3-dioxan-4-yl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(2S,4S,6S)-2-tert-butyl-6-hexyl-1,3-dioxan-4-yl]butanoate Traditional Name: 4-[(2S,4S,6S)-2-tert-butyl-6-hexyl-1,3-dioxan-4-yl]butyric acid ethyl ester Formula: C20H38O4 MolecularWeight: 342.51332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC(OC(O1)C(C)(C)C)CCCC(=O)OCC

Isomeric SMILES

CCCCCC[C@H]1C[C@@H](O[C@H](O1)C(C)(C)C)CCCC(=O)OCC

InChI

InChI=1S/C20H38O4/c1-6-8-9-10-12-16-15-17(13-11-14-18(21)22-7-2)24-19(23-16)20(3,4)5/h16-17,19H,6-15H2,1-5H3/t16-,17-,19-/m0/s1