5-(octylamino)isoindole-1,3-dione

Systemtic Name: 5-(octylamino)isoindole-1,3-dione Openeye Name: 5-(octylamino)isoindoline-1,3-dione CAS Name: 5-(octylamino)isoindole-1,3-dione IUPAC Name: 5-(octylamino)isoindole-1,3-dione Traditional Name: 5-(octylamino)isoindoline-1,3-quinone Formula: C16H22N2O2 MolecularWeight: 274.35808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=CC2=C(C=C1)C(=O)NC2=O

Isomeric SMILES

CCCCCCCCNC1=CC2=C(C=C1)C(=O)NC2=O

InChI

InChI=1S/C16H22N2O2/c1-2-3-4-5-6-7-10-17-12-8-9-13-14(11-12)16(20)18-15(13)19/h8-9,11,17H,2-7,10H2,1H3,(H,18,19,20)