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

Systemtic Name: 5-(2-nitrophenyl)-4-[oxidanyl(phenyl)methylidene]-1-pyridin-1-ium-3-yl-pyrrolidine-2,3-dione Openeye Name: 4-[hydroxy(phenyl)methylene]-5-(2-nitrophenyl)-1-pyridin-1-ium-3-yl-pyrrolidine-2,3-dione CAS Name: 4-[hydroxy(phenyl)methylidene]-5-(2-nitrophenyl)-1-(3-pyridin-1-iumyl)pyrrolidine-2,3-dione IUPAC Name: 4-[hydroxy(phenyl)methylidene]-5-(2-nitrophenyl)-1-pyridin-1-ium-3-ylpyrrolidine-2,3-dione Traditional Name: 4-[hydroxy(phenyl)methylene]-5-(2-nitrophenyl)-1-pyridin-1-ium-3-yl-pyrrolidine-2,3-quinone Formula: C22H16N3O5+ MolecularWeight: 402.37954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=C[NH+]=CC=C3)C4=CC=CC=C4[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=C[NH+]=CC=C3)C4=CC=CC=C4[N+](=O)[O-])O

InChI

InChI=1S/C22H15N3O5/c26-20(14-7-2-1-3-8-14)18-19(16-10-4-5-11-17(16)25(29)30)24(22(28)21(18)27)15-9-6-12-23-13-15/h1-13,19,26H/p+1