5-octylisoindole-1,3-dione

Systemtic Name: 5-octylisoindole-1,3-dione Openeye Name: 5-octylisoindoline-1,3-dione CAS Name: 5-octylisoindole-1,3-dione IUPAC Name: 5-octylisoindole-1,3-dione Traditional Name: 5-octylisoindoline-1,3-quinone Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC2=C(C=C1)C(=O)NC2=O

Isomeric SMILES

CCCCCCCCC1=CC2=C(C=C1)C(=O)NC2=O

InChI

InChI=1S/C16H21NO2/c1-2-3-4-5-6-7-8-12-9-10-13-14(11-12)16(19)17-15(13)18/h9-11H,2-8H2,1H3,(H,17,18,19)