N-(1-adamantyl)-4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]butanamide

Systemtic Name: N-(1-adamantyl)-4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]butanamide Openeye Name: N-(1-adamantyl)-4-(1,3-dioxobenzo[de]isoquinolin-2-yl)butanamide CAS Name: N-(1-adamantyl)-4-(1,3-dioxo-2-benzo[de]isoquinolinyl)butanamide IUPAC Name: N-(1-adamantyl)-4-(1,3-dioxobenzo[de]isoquinolin-2-yl)butanamide Traditional Name: N-(1-adamantyl)-4-(1,3-diketobenzo[de]isoquinolin-2-yl)butyramide Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CCCN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CCCN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O

InChI

InChI=1S/C26H28N2O3/c29-22(27-26-13-16-10-17(14-26)12-18(11-16)15-26)8-3-9-28-24(30)20-6-1-4-19-5-2-7-21(23(19)20)25(28)31/h1-2,4-7,16-18H,3,8-15H2,(H,27,29)