4-[[2-(1,3-benzodioxol-5-ylmethoxy)-3-nitro-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[[2-(1,3-benzodioxol-5-ylmethoxy)-3-nitro-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[2-(1,3-benzodioxol-5-ylmethoxy)-3-nitro-phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[2-(1,3-benzodioxol-5-ylmethoxy)-3-nitrophenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[2-(1,3-benzodioxol-5-ylmethoxy)-3-nitrophenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-(3-nitro-2-piperonyloxy-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C24H17N3O7 MolecularWeight: 459.40768

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COC3=C(C=CC=C3[N+](=O)[O-])C=C4C(=O)NN(C4=O)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COC3=C(C=CC=C3[N+](=O)[O-])C=C4C(=O)NN(C4=O)C5=CC=CC=C5

InChI

InChI=1S/C24H17N3O7/c28-23-18(24(29)26(25-23)17-6-2-1-3-7-17)12-16-5-4-8-19(27(30)31)22(16)32-13-15-9-10-20-21(11-15)34-14-33-20/h1-12H,13-14H2,(H,25,28)