2-pent-4-yn-2-ylisoindole-1,3-dione

Systemtic Name: 2-pent-4-yn-2-ylisoindole-1,3-dione Openeye Name: 2-(1-methylbut-3-ynyl)isoindoline-1,3-dione CAS Name: 2-pent-4-yn-2-ylisoindole-1,3-dione IUPAC Name: 2-pent-4-yn-2-ylisoindole-1,3-dione Traditional Name: 2-(1-methylbut-3-ynyl)isoindoline-1,3-quinone Formula: C13H11NO2 MolecularWeight: 213.23194

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC#C)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CC(CC#C)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C13H11NO2/c1-3-6-9(2)14-12(15)10-7-4-5-8-11(10)13(14)16/h1,4-5,7-9H,6H2,2H3