5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-3-[(2-nitrophenyl)methyl]-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-3-[(2-nitrophenyl)methyl]-1,3-thiazolidine-2,4-dione Openeye Name: 5-[(4-hydroxy-3-nitro-phenyl)methylene]-3-[(2-nitrophenyl)methyl]thiazolidine-2,4-dione CAS Name: 5-[(4-hydroxy-3-nitrophenyl)methylidene]-3-[(2-nitrophenyl)methyl]thiazolidine-2,4-dione IUPAC Name: 5-[(4-hydroxy-3-nitrophenyl)methylidene]-3-[(2-nitrophenyl)methyl]-1,3-thiazolidine-2,4-dione Traditional Name: 5-(4-hydroxy-3-nitro-benzylidene)-3-(2-nitrobenzyl)thiazolidine-2,4-quinone Formula: C17H11N3O7S MolecularWeight: 401.35014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=O)C(=CC3=CC(=C(C=C3)O)[N+](=O)[O-])SC2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=O)C(=CC3=CC(=C(C=C3)O)[N+](=O)[O-])SC2=O)[N+](=O)[O-]

InChI

InChI=1S/C17H11N3O7S/c21-14-6-5-10(7-13(14)20(26)27)8-15-16(22)18(17(23)28-15)9-11-3-1-2-4-12(11)19(24)25/h1-8,21H,9H2