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

Systemtic Name: 4-[(3-chloranyl-4-ethoxy-5-nitro-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[(3-chloro-4-ethoxy-5-nitro-phenyl)methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[(3-chloro-4-ethoxy-5-nitrophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[(3-chloro-4-ethoxy-5-nitrophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-(3-chloro-4-ethoxy-5-nitro-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C18H14ClN3O5 MolecularWeight: 387.77386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14ClN3O5/c1-2-27-16-14(19)9-11(10-15(16)22(25)26)8-13-17(23)20-21(18(13)24)12-6-4-3-5-7-12/h3-10H,2H2,1H3,(H,20,23)