2-(3-ethynylphenyl)isoindole-1,3-dione

Systemtic Name: 2-(3-ethynylphenyl)isoindole-1,3-dione Openeye Name: 2-(3-ethynylphenyl)isoindoline-1,3-dione CAS Name: 2-(3-ethynylphenyl)isoindole-1,3-dione IUPAC Name: 2-(3-ethynylphenyl)isoindole-1,3-dione Traditional Name: 2-(3-ethynylphenyl)isoindoline-1,3-quinone Formula: C16H9NO2 MolecularWeight: 247.24816

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C#CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H9NO2/c1-2-11-6-5-7-12(10-11)17-15(18)13-8-3-4-9-14(13)16(17)19/h1,3-10H