N-cyclooctyl-2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide

Systemtic Name: N-cyclooctyl-2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-cyclooctyl-2-(5-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-cyclooctyl-2-(5-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-cyclooctyl-2-(5-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-cyclooctyl-2-(1,3-diketo-5-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=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O5/c22-16(19-12-6-4-2-1-3-5-7-12)11-20-17(23)14-9-8-13(21(25)26)10-15(14)18(20)24/h8-10,12H,1-7,11H2,(H,19,22)