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

Systemtic Name: ethyl 3-[(2S,4S,6S)-2-tert-butyl-6-hexyl-1,3-dioxan-4-yl]propanoate Openeye Name: ethyl 3-[(2S,4S,6S)-2-tert-butyl-6-hexyl-1,3-dioxan-4-yl]propanoate CAS Name: 3-[(2S,4S,6S)-2-tert-butyl-6-hexyl-1,3-dioxan-4-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(2S,4S,6S)-2-tert-butyl-6-hexyl-1,3-dioxan-4-yl]propanoate Traditional Name: 3-[(2S,4S,6S)-2-tert-butyl-6-hexyl-1,3-dioxan-4-yl]propionic acid ethyl ester Formula: C19H36O4 MolecularWeight: 328.48674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H36O4/c1-6-8-9-10-11-15-14-16(12-13-17(20)21-7-2)23-18(22-15)19(3,4)5/h15-16,18H,6-14H2,1-5H3/t15-,16-,18-/m0/s1