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

Systemtic Name: 2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-(5-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: 2-(5-nitro-1,3-dioxo-2-isoindolyl)-N-[oxo-(prop-2-enylamino)methyl]acetamide IUPAC Name: 2-(5-nitro-1,3-dioxoisoindol-2-yl)-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-(1,3-diketo-5-nitro-isoindolin-2-yl)acetamide Formula: C14H12N4O6 MolecularWeight: 332.26828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N4O6/c1-2-5-15-14(22)16-11(19)7-17-12(20)9-4-3-8(18(23)24)6-10(9)13(17)21/h2-4,6H,1,5,7H2,(H2,15,16,19,22)