(E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-[2-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-[2-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enamide CAS Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-[2-(2-oxo-1-pyrrolidinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-N-[2-(2-ketopyrrolidino)phenyl]-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C20H17N3O6 MolecularWeight: 395.36548

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=CC=C2NC(=O)C=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=CC=C2NC(=O)/C=C/C3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C20H17N3O6/c24-19(21-14-4-1-2-5-15(14)22-9-3-6-20(22)25)8-7-13-10-17-18(29-12-28-17)11-16(13)23(26)27/h1-2,4-5,7-8,10-11H,3,6,9,12H2,(H,21,24)/b8-7+