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

Systemtic Name: N-[5-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]adamantane-1-carboxamide Openeye Name: N-(5-nitro-1,3-dioxo-benzo[de]isoquinolin-2-yl)adamantane-1-carboxamide CAS Name: N-(5-nitro-1,3-dioxo-2-benzo[de]isoquinolinyl)-1-adamantanecarboxamide IUPAC Name: N-(5-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)adamantane-1-carboxamide Traditional Name: N-(1,3-diketo-5-nitro-benzo[de]isoquinolin-2-yl)adamantane-1-carboxamide Formula: C23H21N3O5 MolecularWeight: 419.42994

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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)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NN4C(=O)C5=CC=CC6=CC(=CC(=C65)C4=O)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O5/c27-20-17-3-1-2-15-7-16(26(30)31)8-18(19(15)17)21(28)25(20)24-22(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,24,29)