4-[(3-methoxy-5-nitro-4-propan-2-yloxy-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[(3-methoxy-5-nitro-4-propan-2-yloxy-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[(4-isopropoxy-3-methoxy-5-nitro-phenyl)methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[(3-methoxy-5-nitro-4-propan-2-yloxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[(3-methoxy-5-nitro-4-propan-2-yloxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-(4-isopropoxy-3-methoxy-5-nitro-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1OC)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1OC)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O6/c1-12(2)29-18-16(23(26)27)10-13(11-17(18)28-3)9-15-19(24)21-22(20(15)25)14-7-5-4-6-8-14/h4-12H,1-3H3,(H,21,24)