3-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]pyrrolidin-2-one

Systemtic Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]pyrrolidin-2-one Openeye Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylene]pyrrolidin-2-one CAS Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-2-pyrrolidinone IUPAC Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]pyrrolidin-2-one Traditional Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylene]-2-pyrrolidone Formula: C12H10N2O5 MolecularWeight: 262.2182

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C1=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

C1CNC(=O)C1=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C12H10N2O5/c15-12-7(1-2-13-12)3-8-4-10-11(19-6-18-10)5-9(8)14(16)17/h3-5H,1-2,6H2,(H,13,15)