2-[2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-ethyl-amino]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-ethyl-amino]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-ethyl-amino]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-ethylamino]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-ethylamino]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[[(E)-6,6-dimethylhept-2-en-4-ynyl]-ethyl-amino]ethyl]isoindoline-1,3-quinone Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCN1C(=O)C2=CC=CC=C2C1=O)CC=CC#CC(C)(C)C

Isomeric SMILES

CCN(CCN1C(=O)C2=CC=CC=C2C1=O)C/C=C/C#CC(C)(C)C

InChI

InChI=1S/C21H26N2O2/c1-5-22(14-10-6-9-13-21(2,3)4)15-16-23-19(24)17-11-7-8-12-18(17)20(23)25/h6-8,10-12H,5,14-16H2,1-4H3/b10-6+