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

Systemtic Name: 2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-(5-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: 2-(5-nitro-1,3-dioxo-2-isoindolyl)-N-prop-2-enylacetamide IUPAC Name: 2-(5-nitro-1,3-dioxoisoindol-2-yl)-N-prop-2-enylacetamide Traditional Name: N-allyl-2-(1,3-diketo-5-nitro-isoindolin-2-yl)acetamide Formula: C13H11N3O5 MolecularWeight: 289.24354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O5/c1-2-5-14-11(17)7-15-12(18)9-4-3-8(16(20)21)6-10(9)13(15)19/h2-4,6H,1,5,7H2,(H,14,17)