N-[2-(1-adamantyl)ethyl]-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide

Systemtic Name: N-[2-(1-adamantyl)ethyl]-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-[2-(1-adamantyl)ethyl]-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-[2-(1-adamantyl)ethyl]-2-(4-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-[2-(1-adamantyl)ethyl]-2-(4-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-[2-(1-adamantyl)ethyl]-2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetamide Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCNC(=O)CN4C(=O)C5=C(C4=O)C(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CCNC(=O)CN4C(=O)C5=C(C4=O)C(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O5/c26-18(23-5-4-22-9-13-6-14(10-22)8-15(7-13)11-22)12-24-20(27)16-2-1-3-17(25(29)30)19(16)21(24)28/h1-3,13-15H,4-12H2,(H,23,26)