methyl 3-oxidanylidene-3-[2-(2-phenylethynyl)phenyl]propanoate

Systemtic Name: methyl 3-oxidanylidene-3-[2-(2-phenylethynyl)phenyl]propanoate Openeye Name: methyl 3-oxo-3-[2-(2-phenylethynyl)phenyl]propanoate CAS Name: 3-oxo-3-[2-(2-phenylethynyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-oxo-3-[2-(2-phenylethynyl)phenyl]propanoate Traditional Name: 3-keto-3-[2-(2-phenylethynyl)phenyl]propionic acid methyl ester Formula: C18H14O3 MolecularWeight: 278.30196

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)C1=CC=CC=C1C#CC2=CC=CC=C2

Isomeric SMILES

COC(=O)CC(=O)C1=CC=CC=C1C#CC2=CC=CC=C2

InChI

InChI=1S/C18H14O3/c1-21-18(20)13-17(19)16-10-6-5-9-15(16)12-11-14-7-3-2-4-8-14/h2-10H,13H2,1H3