2-(4-imidazol-1-ylbut-2-ynyl)isoindole-1,3-dione

Systemtic Name: 2-(4-imidazol-1-ylbut-2-ynyl)isoindole-1,3-dione Openeye Name: 2-(4-imidazol-1-ylbut-2-ynyl)isoindoline-1,3-dione CAS Name: 2-[4-(1-imidazolyl)but-2-ynyl]isoindole-1,3-dione IUPAC Name: 2-(4-imidazol-1-ylbut-2-ynyl)isoindole-1,3-dione Traditional Name: 2-(4-imidazol-1-ylbut-2-ynyl)isoindoline-1,3-quinone Formula: C15H11N3O2 MolecularWeight: 265.26674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC#CCN3C=CN=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC#CCN3C=CN=C3

InChI

InChI=1S/C15H11N3O2/c19-14-12-5-1-2-6-13(12)15(20)18(14)9-4-3-8-17-10-7-16-11-17/h1-2,5-7,10-11H,8-9H2