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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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