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

Systemtic Name: (4E)-4-[(3-chloranyl-4-methoxy-phenyl)-oxidanyl-methylidene]-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(3-chloro-4-methoxy-phenyl)-hydroxy-methylene]-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[(3-chloro-4-methoxyphenyl)-hydroxymethylidene]-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(3-chloro-4-methoxyphenyl)-hydroxymethylidene]-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione Traditional Name: (4E)-4-[(3-chloro-4-methoxy-phenyl)-hydroxy-methylene]-1-[3-(1H-imidazol-3-ium-3-yl)propyl]-5-(3-methoxyphenyl)pyrrolidine-2,3-quinone Formula: C25H25ClN3O5+ MolecularWeight: 482.9361

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCC[N+]3=CNC=C3)C4=CC(=CC=C4)OC)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCC[N+]3=CNC=C3)C4=CC(=CC=C4)OC)/O)Cl

InChI

InChI=1S/C25H24ClN3O5/c1-33-18-6-3-5-16(13-18)22-21(23(30)17-7-8-20(34-2)19(26)14-17)24(31)25(32)29(22)11-4-10-28-12-9-27-15-28/h3,5-9,12-15,22H,4,10-11H2,1-2H3,(H,30,31)/p+1