[(2S)-4-phenylbut-3-yn-2-yl] butanoate

Systemtic Name: [(2S)-4-phenylbut-3-yn-2-yl] butanoate Openeye Name: [(1S)-1-methyl-3-phenyl-prop-2-ynyl] butanoate CAS Name: butanoic acid [(2S)-4-phenylbut-3-yn-2-yl] ester IUPAC Name: [(2S)-4-phenylbut-3-yn-2-yl] butanoate Traditional Name: butyric acid [(1S)-1-methyl-3-phenyl-prop-2-ynyl] ester Formula: C14H16O2 MolecularWeight: 216.27564

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(C)C#CC1=CC=CC=C1

Isomeric SMILES

CCCC(=O)O[C@@H](C)C#CC1=CC=CC=C1

InChI

InChI=1S/C14H16O2/c1-3-7-14(15)16-12(2)10-11-13-8-5-4-6-9-13/h4-6,8-9,12H,3,7H2,1-2H3/t12-/m0/s1