2-[5-(diethylamino)pent-3-yn-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[5-(diethylamino)pent-3-yn-2-yl]isoindole-1,3-dione Openeye Name: 2-[4-(diethylamino)-1-methyl-but-2-ynyl]isoindoline-1,3-dione CAS Name: 2-[5-(diethylamino)pent-3-yn-2-yl]isoindole-1,3-dione IUPAC Name: 2-[5-(diethylamino)pent-3-yn-2-yl]isoindole-1,3-dione Traditional Name: 2-[4-(diethylamino)-1-methyl-but-2-ynyl]isoindoline-1,3-quinone Formula: C17H20N2O2 MolecularWeight: 284.3529

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O2/c1-4-18(5-2)12-8-9-13(3)19-16(20)14-10-6-7-11-15(14)17(19)21/h6-7,10-11,13H,4-5,12H2,1-3H3