1-(4-fluorophenyl)-5-[(5-methoxy-2-nitro-4-phenylmethoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(4-fluorophenyl)-5-[(5-methoxy-2-nitro-4-phenylmethoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(4-benzyloxy-5-methoxy-2-nitro-phenyl)methylene]-1-(4-fluorophenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-fluorophenyl)-5-[(5-methoxy-2-nitro-4-phenylmethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-fluorophenyl)-5-[(5-methoxy-2-nitro-4-phenylmethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(4-benzoxy-5-methoxy-2-nitro-benzylidene)-1-(4-fluorophenyl)barbituric acid Formula: C25H18FN3O7 MolecularWeight: 491.424723

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)F)[N+](=O)[O-])OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)F)[N+](=O)[O-])OCC4=CC=CC=C4

InChI

InChI=1S/C25H18FN3O7/c1-35-21-12-16(20(29(33)34)13-22(21)36-14-15-5-3-2-4-6-15)11-19-23(30)27-25(32)28(24(19)31)18-9-7-17(26)8-10-18/h2-13H,14H2,1H3,(H,27,30,32)