(E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enamide CAS Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-[4-(2-oxo-1-pyrrolidinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-N-[4-(2-ketopyrrolidino)phenyl]-3-(6-nitro-4H-1,3-benzodioxin-8-yl)acrylamide Formula: C21H19N3O6 MolecularWeight: 409.39206

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)C=CC3=CC(=CC4=C3OCOC4)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)/C=C/C3=CC(=CC4=C3OCOC4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O6/c25-19(22-16-4-6-17(7-5-16)23-9-1-2-20(23)26)8-3-14-10-18(24(27)28)11-15-12-29-13-30-21(14)15/h3-8,10-11H,1-2,9,12-13H2,(H,22,25)/b8-3+