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

Systemtic Name: N-cyclooctyl-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-cyclooctyl-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-cyclooctyl-2-(4-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-cyclooctyl-2-(4-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-cyclooctyl-2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetamide Formula: C18H21N3O5 MolecularWeight: 359.37644

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O5/c22-15(19-12-7-4-2-1-3-5-8-12)11-20-17(23)13-9-6-10-14(21(25)26)16(13)18(20)24/h6,9-10,12H,1-5,7-8,11H2,(H,19,22)