6-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(4-iodophenyl)hexanamide

Systemtic Name: 6-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(4-iodophenyl)hexanamide Openeye Name: 6-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-(4-iodophenyl)hexanamide CAS Name: 6-(1,3-dioxo-2-benzo[de]isoquinolinyl)-N-(4-iodophenyl)hexanamide IUPAC Name: 6-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-(4-iodophenyl)hexanamide Traditional Name: 6-(1,3-diketobenzo[de]isoquinolin-2-yl)-N-(4-iodophenyl)hexanamide Formula: C24H21IN2O3 MolecularWeight: 512.33961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)CCCCCC(=O)NC4=CC=C(C=C4)I

Isomeric SMILES

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)CCCCCC(=O)NC4=CC=C(C=C4)I

InChI

InChI=1S/C24H21IN2O3/c25-17-11-13-18(14-12-17)26-21(28)10-2-1-3-15-27-23(29)19-8-4-6-16-7-5-9-20(22(16)19)24(27)30/h4-9,11-14H,1-3,10,15H2,(H,26,28)