4-[(3-ethoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione

Systemtic Name: 4-[(3-ethoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione Openeye Name: 4-[(3-ethoxy-4-hydroxy-5-nitro-phenyl)methylene]-1-(m-tolyl)pyrazolidine-3,5-dione CAS Name: 4-[(3-ethoxy-4-hydroxy-5-nitrophenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione IUPAC Name: 4-[(3-ethoxy-4-hydroxy-5-nitrophenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione Traditional Name: 4-(3-ethoxy-4-hydroxy-5-nitro-benzylidene)-1-(m-tolyl)pyrazolidine-3,5-quinone Formula: C19H17N3O6 MolecularWeight: 383.35478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C=C2C(=O)NN(C2=O)C3=CC=CC(=C3)C

Isomeric SMILES

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C=C2C(=O)NN(C2=O)C3=CC=CC(=C3)C

InChI

InChI=1S/C19H17N3O6/c1-3-28-16-10-12(9-15(17(16)23)22(26)27)8-14-18(24)20-21(19(14)25)13-6-4-5-11(2)7-13/h4-10,23H,3H2,1-2H3,(H,20,24)