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

Systemtic Name: 2-(4-pyrrolidin-1-ylbut-2-ynyl)isoindole-1,3-dione Openeye Name: 2-(4-pyrrolidin-1-ylbut-2-ynyl)isoindoline-1,3-dione CAS Name: 2-[4-(1-pyrrolidinyl)but-2-ynyl]isoindole-1,3-dione IUPAC Name: 2-(4-pyrrolidin-1-ylbut-2-ynyl)isoindole-1,3-dione Traditional Name: 2-(4-pyrrolidinobut-2-ynyl)isoindoline-1,3-quinone Formula: C16H16N2O2 MolecularWeight: 268.31044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC#CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1CCN(C1)CC#CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H16N2O2/c19-15-13-7-1-2-8-14(13)16(20)18(15)12-6-5-11-17-9-3-4-10-17/h1-2,7-8H,3-4,9-12H2