(phenylmethyl) 2-oxidanylidenehex-3-ynoate

Systemtic Name: (phenylmethyl) 2-oxidanylidenehex-3-ynoate Openeye Name: benzyl 2-oxohex-3-ynoate CAS Name: 2-oxo-3-hexynoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-oxohex-3-ynoate Traditional Name: 2-ketohex-3-ynoic acid benzyl ester Formula: C13H12O3 MolecularWeight: 216.23258

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC(=O)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCC#CC(=O)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C13H12O3/c1-2-3-9-12(14)13(15)16-10-11-7-5-4-6-8-11/h4-8H,2,10H2,1H3