N-[2-[6-bromanyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethyl]-4-tert-butyl-N-phenyl-benzamide

Systemtic Name: N-[2-[6-bromanyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]ethyl]-4-tert-butyl-N-phenyl-benzamide Openeye Name: N-[2-(6-bromo-1,3-dioxo-benzo[de]isoquinolin-2-yl)ethyl]-4-tert-butyl-N-phenyl-benzamide CAS Name: N-[2-(6-bromo-1,3-dioxo-2-benzo[de]isoquinolinyl)ethyl]-4-tert-butyl-N-phenylbenzamide IUPAC Name: N-[2-(6-bromo-1,3-dioxobenzo[de]isoquinolin-2-yl)ethyl]-4-tert-butyl-N-phenylbenzamide Traditional Name: N-[2-(6-bromo-1,3-diketo-benzo[de]isoquinolin-2-yl)ethyl]-4-tert-butyl-N-phenyl-benzamide Formula: C31H27BrN2O3 MolecularWeight: 555.46168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CCN2C(=O)C3=C4C(=C(C=C3)Br)C=CC=C4C2=O)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CCN2C(=O)C3=C4C(=C(C=C3)Br)C=CC=C4C2=O)C5=CC=CC=C5

InChI

InChI=1S/C31H27BrN2O3/c1-31(2,3)21-14-12-20(13-15-21)28(35)33(22-8-5-4-6-9-22)18-19-34-29(36)24-11-7-10-23-26(32)17-16-25(27(23)24)30(34)37/h4-17H,18-19H2,1-3H3