N-[5-bromanyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[5-bromanyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]adamantane-1-carboxamide Openeye Name: N-(5-bromo-1,3-dioxo-benzo[de]isoquinolin-2-yl)adamantane-1-carboxamide CAS Name: N-(5-bromo-1,3-dioxo-2-benzo[de]isoquinolinyl)-1-adamantanecarboxamide IUPAC Name: N-(5-bromo-1,3-dioxobenzo[de]isoquinolin-2-yl)adamantane-1-carboxamide Traditional Name: N-(5-bromo-1,3-diketo-benzo[de]isoquinolin-2-yl)adamantane-1-carboxamide Formula: C23H21BrN2O3 MolecularWeight: 453.32844

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NN4C(=O)C5=CC=CC6=CC(=CC(=C65)C4=O)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NN4C(=O)C5=CC=CC6=CC(=CC(=C65)C4=O)Br

InChI

InChI=1S/C23H21BrN2O3/c24-16-7-15-2-1-3-17-19(15)18(8-16)21(28)26(20(17)27)25-22(29)23-9-12-4-13(10-23)6-14(5-12)11-23/h1-3,7-8,12-14H,4-6,9-11H2,(H,25,29)