(4-but-1-ynylphenyl) 1,3-dioxane-2-carboxylate

Systemtic Name: (4-but-1-ynylphenyl) 1,3-dioxane-2-carboxylate Openeye Name: (4-but-1-ynylphenyl) 1,3-dioxane-2-carboxylate CAS Name: 1,3-dioxane-2-carboxylic acid (4-but-1-ynylphenyl) ester IUPAC Name: (4-but-1-ynylphenyl) 1,3-dioxane-2-carboxylate Traditional Name: 1,3-dioxane-2-carboxylic acid (4-but-1-ynylphenyl) ester Formula: C15H16O4 MolecularWeight: 260.28514

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC1=CC=C(C=C1)OC(=O)C2OCCCO2

Isomeric SMILES

CCC#CC1=CC=C(C=C1)OC(=O)C2OCCCO2

InChI

InChI=1S/C15H16O4/c1-2-3-5-12-6-8-13(9-7-12)19-14(16)15-17-10-4-11-18-15/h6-9,15H,2,4,10-11H2,1H3