5-(2-phenylethynyl)-2-benzofuran-1,3-dione

Systemtic Name: 5-(2-phenylethynyl)-2-benzofuran-1,3-dione Openeye Name: 5-(2-phenylethynyl)isobenzofuran-1,3-dione CAS Name: 5-(2-phenylethynyl)isobenzofuran-1,3-dione IUPAC Name: 5-(2-phenylethynyl)-2-benzofuran-1,3-dione Traditional Name: 5-(2-phenylethynyl)phthalan-1,3-quinone Formula: C16H8O3 MolecularWeight: 248.23292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C(=O)OC3=O

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C(=O)OC3=O

InChI

InChI=1S/C16H8O3/c17-15-13-9-8-12(10-14(13)16(18)19-15)7-6-11-4-2-1-3-5-11/h1-5,8-10H