ethyl 2-[(2R,4S,6R)-2,5,5-trimethyl-6-phenethyl-1,3-dioxan-4-yl]ethanoate

Systemtic Name: ethyl 2-[(2R,4S,6R)-2,5,5-trimethyl-6-phenethyl-1,3-dioxan-4-yl]ethanoate Openeye Name: ethyl 2-[(2R,4S,6R)-2,5,5-trimethyl-6-phenethyl-1,3-dioxan-4-yl]acetate CAS Name: 2-[(2R,4S,6R)-2,5,5-trimethyl-6-phenethyl-1,3-dioxan-4-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2R,4S,6R)-2,5,5-trimethyl-6-phenethyl-1,3-dioxan-4-yl]acetate Traditional Name: 2-[(2R,4S,6R)-2,5,5-trimethyl-6-phenethyl-1,3-dioxan-4-yl]acetic acid ethyl ester Formula: C19H28O4 MolecularWeight: 320.42322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(C(OC(O1)C)CCC2=CC=CC=C2)(C)C

Isomeric SMILES

CCOC(=O)C[C@H]1C([C@H](O[C@H](O1)C)CCC2=CC=CC=C2)(C)C

InChI

InChI=1S/C19H28O4/c1-5-21-18(20)13-17-19(3,4)16(22-14(2)23-17)12-11-15-9-7-6-8-10-15/h6-10,14,16-17H,5,11-13H2,1-4H3/t14-,16-,17+/m1/s1