(4-oxidanyl-4-phenyl-pent-2-ynyl) ethanoate

Systemtic Name: (4-oxidanyl-4-phenyl-pent-2-ynyl) ethanoate Openeye Name: (4-hydroxy-4-phenyl-pent-2-ynyl) acetate CAS Name: acetic acid (4-hydroxy-4-phenylpent-2-ynyl) ester IUPAC Name: (4-hydroxy-4-phenylpent-2-ynyl) acetate Traditional Name: acetic acid (4-hydroxy-4-phenyl-pent-2-ynyl) ester Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC#CC(C)(C1=CC=CC=C1)O

Isomeric SMILES

CC(=O)OCC#CC(C)(C1=CC=CC=C1)O

InChI

InChI=1S/C13H14O3/c1-11(14)16-10-6-9-13(2,15)12-7-4-3-5-8-12/h3-5,7-8,15H,10H2,1-2H3