2-[4-(azocan-1-yl)but-2-ynyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(azocan-1-yl)but-2-ynyl]isoindole-1,3-dione Openeye Name: 2-[4-(azocan-1-yl)but-2-ynyl]isoindoline-1,3-dione CAS Name: 2-[4-(1-azocanyl)but-2-ynyl]isoindole-1,3-dione IUPAC Name: 2-[4-(azocan-1-yl)but-2-ynyl]isoindole-1,3-dione Traditional Name: 2-[4-(azocan-1-yl)but-2-ynyl]isoindoline-1,3-quinone Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)CC#CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1CCCN(CCC1)CC#CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H22N2O2/c22-18-16-10-4-5-11-17(16)19(23)21(18)15-9-8-14-20-12-6-2-1-3-7-13-20/h4-5,10-11H,1-3,6-7,12-15H2