(3E)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-1-phenyl-pyrrolidine-2,5-dione

Systemtic Name: (3E)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-1-phenyl-pyrrolidine-2,5-dione Openeye Name: (3E)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylene]-1-phenyl-pyrrolidine-2,5-dione CAS Name: (3E)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-1-phenylpyrrolidine-2,5-dione IUPAC Name: (3E)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-1-phenylpyrrolidine-2,5-dione Traditional Name: (3E)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylene]-1-phenyl-pyrrolidine-2,5-quinone Formula: C18H12N2O6 MolecularWeight: 352.29768

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)C(=O)N(C1=O)C4=CC=CC=C4

Isomeric SMILES

C1/C(=C\C2=CC3=C(C=C2[N+](=O)[O-])OCO3)/C(=O)N(C1=O)C4=CC=CC=C4

InChI

InChI=1S/C18H12N2O6/c21-17-8-12(18(22)19(17)13-4-2-1-3-5-13)6-11-7-15-16(26-10-25-15)9-14(11)20(23)24/h1-7,9H,8,10H2/b12-6+