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

Systemtic Name: N-tert-butyl-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-tert-butyl-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-tert-butyl-2-(4-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-tert-butyl-2-(4-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-tert-butyl-2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetamide Formula: C14H15N3O5 MolecularWeight: 305.286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O5/c1-14(2,3)15-10(18)7-16-12(19)8-5-4-6-9(17(21)22)11(8)13(16)20/h4-6H,7H2,1-3H3,(H,15,18)