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

Systemtic Name: 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(propylcarbamoyl)ethanamide Openeye Name: 2-(4-nitro-1,3-dioxo-isoindolin-2-yl)-N-(propylcarbamoyl)acetamide CAS Name: 2-(4-nitro-1,3-dioxo-2-isoindolyl)-N-[oxo(propylamino)methyl]acetamide IUPAC Name: 2-(4-nitro-1,3-dioxoisoindol-2-yl)-N-(propylcarbamoyl)acetamide Traditional Name: 2-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-(propylcarbamoyl)acetamide Formula: C14H14N4O6 MolecularWeight: 334.28416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N4O6/c1-2-6-15-14(22)16-10(19)7-17-12(20)8-4-3-5-9(18(23)24)11(8)13(17)21/h3-5H,2,6-7H2,1H3,(H2,15,16,19,22)