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

Systemtic Name: 4-[(4-fluorophenyl)-oxidanyl-methylidene]-5-(3-nitrophenyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione Openeye Name: 4-[(4-fluorophenyl)-hydroxy-methylene]-5-(3-nitrophenyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione CAS Name: 4-[(4-fluorophenyl)-hydroxymethylidene]-5-(3-nitrophenyl)-1-(3-pyridin-1-iumylmethyl)pyrrolidine-2,3-dione IUPAC Name: 4-[(4-fluorophenyl)-hydroxymethylidene]-5-(3-nitrophenyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-dione Traditional Name: 4-[(4-fluorophenyl)-hydroxy-methylene]-5-(3-nitrophenyl)-1-(pyridin-1-ium-3-ylmethyl)pyrrolidine-2,3-quinone Formula: C23H17FN3O5+ MolecularWeight: 434.396583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2C(=C(C3=CC=C(C=C3)F)O)C(=O)C(=O)N2CC4=C[NH+]=CC=C4

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2C(=C(C3=CC=C(C=C3)F)O)C(=O)C(=O)N2CC4=C[NH+]=CC=C4

InChI

InChI=1S/C23H16FN3O5/c24-17-8-6-15(7-9-17)21(28)19-20(16-4-1-5-18(11-16)27(31)32)26(23(30)22(19)29)13-14-3-2-10-25-12-14/h1-12,20,28H,13H2/p+1