2-[(2S,4R,5S)-5-ethyl-2-(4-methoxyphenyl)-1,3-dioxan-4-yl]ethanoic acid

Systemtic Name: 2-[(2S,4R,5S)-5-ethyl-2-(4-methoxyphenyl)-1,3-dioxan-4-yl]ethanoic acid Openeye Name: 2-[(2S,4R,5S)-5-ethyl-2-(4-methoxyphenyl)-1,3-dioxan-4-yl]acetic acid CAS Name: 2-[(2S,4R,5S)-5-ethyl-2-(4-methoxyphenyl)-1,3-dioxan-4-yl]acetic acid IUPAC Name: 2-[(2S,4R,5S)-5-ethyl-2-(4-methoxyphenyl)-1,3-dioxan-4-yl]acetic acid Traditional Name: 2-[(2S,4R,5S)-5-ethyl-2-(4-methoxyphenyl)-1,3-dioxan-4-yl]acetic acid Formula: C15H20O5 MolecularWeight: 280.3163

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COC(OC1CC(=O)O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC[C@H]1CO[C@@H](O[C@@H]1CC(=O)O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C15H20O5/c1-3-10-9-19-15(20-13(10)8-14(16)17)11-4-6-12(18-2)7-5-11/h4-7,10,13,15H,3,8-9H2,1-2H3,(H,16,17)/t10-,13+,15-/m0/s1