(4E)-4-[(3-chloranyl-4-ethoxy-phenyl)-oxidanyl-methylidene]-5-(4-fluorophenyl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]pyrrolidine-2,3-dione

Systemtic Name: (4E)-4-[(3-chloranyl-4-ethoxy-phenyl)-oxidanyl-methylidene]-5-(4-fluorophenyl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(3-chloro-4-ethoxy-phenyl)-hydroxy-methylene]-5-(4-fluorophenyl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]pyrrolidine-2,3-dione CAS Name: (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-5-(4-fluorophenyl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]pyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(3-chloro-4-ethoxyphenyl)-hydroxymethylidene]-5-(4-fluorophenyl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]pyrrolidine-2,3-dione Traditional Name: (4E)-4-[(3-chloro-4-ethoxy-phenyl)-hydroxy-methylene]-5-(4-fluorophenyl)-1-[3-(1H-imidazol-3-ium-3-yl)propyl]pyrrolidine-2,3-quinone Formula: C25H24ClFN3O4+ MolecularWeight: 484.927163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCC[N+]3=CNC=C3)C4=CC=C(C=C4)F)O)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCC[N+]3=CNC=C3)C4=CC=C(C=C4)F)/O)Cl

InChI

InChI=1S/C25H23ClFN3O4/c1-2-34-20-9-6-17(14-19(20)26)23(31)21-22(16-4-7-18(27)8-5-16)30(25(33)24(21)32)12-3-11-29-13-10-28-15-29/h4-10,13-15,22H,2-3,11-12H2,1H3,(H,31,32)/p+1