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

Systemtic Name: (4E)-4-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-1-(4-methylphenyl)pyrazolidine-3,5-dione Openeye Name: (4E)-4-[(4-hydroxy-3-methoxy-5-nitro-phenyl)methylene]-1-(p-tolyl)pyrazolidine-3,5-dione CAS Name: (4E)-4-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-1-(4-methylphenyl)pyrazolidine-3,5-dione IUPAC Name: (4E)-4-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-1-(4-methylphenyl)pyrazolidine-3,5-dione Traditional Name: (4E)-4-(4-hydroxy-3-methoxy-5-nitro-benzylidene)-1-(p-tolyl)pyrazolidine-3,5-quinone Formula: C18H15N3O6 MolecularWeight: 369.3282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)OC)O)[N+](=O)[O-])C(=O)N2

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC(=C(C(=C3)OC)O)[N+](=O)[O-])/C(=O)N2

InChI

InChI=1S/C18H15N3O6/c1-10-3-5-12(6-4-10)20-18(24)13(17(23)19-20)7-11-8-14(21(25)26)16(22)15(9-11)27-2/h3-9,22H,1-2H3,(H,19,23)/b13-7+