(4S,5S)-4-[(2S)-but-3-yn-2-yl]-2-(4-methoxyphenyl)-5-methyl-1,3-dioxane

Systemtic Name: (4S,5S)-4-[(2S)-but-3-yn-2-yl]-2-(4-methoxyphenyl)-5-methyl-1,3-dioxane Openeye Name: (4S,5S)-2-(4-methoxyphenyl)-5-methyl-4-[(1S)-1-methylprop-2-ynyl]-1,3-dioxane CAS Name: (4S,5S)-4-[(2S)-but-3-yn-2-yl]-2-(4-methoxyphenyl)-5-methyl-1,3-dioxane IUPAC Name: (4S,5S)-4-[(2S)-but-3-yn-2-yl]-2-(4-methoxyphenyl)-5-methyl-1,3-dioxane Traditional Name: (4S,5S)-2-(4-methoxyphenyl)-5-methyl-4-[(1S)-1-methylprop-2-ynyl]-1,3-dioxane Formula: C16H20O3 MolecularWeight: 260.3282

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Descriptors Computed from Structure

Canonical SMILES:

CC1COC(OC1C(C)C#C)C2=CC=C(C=C2)OC

Isomeric SMILES

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

InChI

InChI=1S/C16H20O3/c1-5-11(2)15-12(3)10-18-16(19-15)13-6-8-14(17-4)9-7-13/h1,6-9,11-12,15-16H,10H2,2-4H3/t11-,12-,15-,16?/m0/s1