5-(4-bromophenyl)-4-[(4-fluorophenyl)-oxidanyl-methylidene]-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione

Systemtic Name: 5-(4-bromophenyl)-4-[(4-fluorophenyl)-oxidanyl-methylidene]-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione Openeye Name: 5-(4-bromophenyl)-4-[(4-fluorophenyl)-hydroxy-methylene]-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione CAS Name: 5-(4-bromophenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-1-(3-pyridin-1-iumylmethyl)pyrrolidine-2,3-dione IUPAC Name: 5-(4-bromophenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione Traditional Name: 5-(4-bromophenyl)-4-[(4-fluorophenyl)-hydroxy-methylene]-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-quinone Formula: C23H17BrFN2O3+ MolecularWeight: 468.295083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[NH+]=C1)CN2C(C(=C(C3=CC=C(C=C3)F)O)C(=O)C2=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC(=C[NH+]=C1)CN2C(C(=C(C3=CC=C(C=C3)F)O)C(=O)C2=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H16BrFN2O3/c24-17-7-3-15(4-8-17)20-19(21(28)16-5-9-18(25)10-6-16)22(29)23(30)27(20)13-14-2-1-11-26-12-14/h1-12,20,28H,13H2/p+1