6-nitro-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 6-nitro-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: 6-nitro-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 6-nitro-N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: 6-nitro-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-[4-(2-ketopyrrolidino)benzyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)CNC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCCO4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)CNC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCCO4

InChI

InChI=1S/C20H19N3O6/c24-19-2-1-7-22(19)14-5-3-13(4-6-14)12-21-20(25)15-10-17-18(29-9-8-28-17)11-16(15)23(26)27/h3-6,10-11H,1-2,7-9,12H2,(H,21,25)