[3-(2-oxidanylidenepropyl)-4-(2-phenylethynyl)phenyl] ethanoate

Systemtic Name: [3-(2-oxidanylidenepropyl)-4-(2-phenylethynyl)phenyl] ethanoate Openeye Name: [3-acetonyl-4-(2-phenylethynyl)phenyl] acetate CAS Name: acetic acid [3-(2-oxopropyl)-4-(2-phenylethynyl)phenyl] ester IUPAC Name: [3-(2-oxopropyl)-4-(2-phenylethynyl)phenyl] acetate Traditional Name: acetic acid [3-acetonyl-4-(2-phenylethynyl)phenyl] ester Formula: C19H16O3 MolecularWeight: 292.32854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=C(C=CC(=C1)OC(=O)C)C#CC2=CC=CC=C2

Isomeric SMILES

CC(=O)CC1=C(C=CC(=C1)OC(=O)C)C#CC2=CC=CC=C2

InChI

InChI=1S/C19H16O3/c1-14(20)12-18-13-19(22-15(2)21)11-10-17(18)9-8-16-6-4-3-5-7-16/h3-7,10-11,13H,12H2,1-2H3