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

Systemtic Name: 3-butyl-5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-1,3-thiazolidine-2,4-dione Openeye Name: 3-butyl-5-[(4-hydroxy-3-nitro-phenyl)methylene]thiazolidine-2,4-dione CAS Name: 3-butyl-5-[(4-hydroxy-3-nitrophenyl)methylidene]thiazolidine-2,4-dione IUPAC Name: 3-butyl-5-[(4-hydroxy-3-nitrophenyl)methylidene]-1,3-thiazolidine-2,4-dione Traditional Name: 3-butyl-5-(4-hydroxy-3-nitro-benzylidene)thiazolidine-2,4-quinone Formula: C14H14N2O5S MolecularWeight: 322.33636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=CC(=C(C=C2)O)[N+](=O)[O-])SC1=O

Isomeric SMILES

CCCCN1C(=O)C(=CC2=CC(=C(C=C2)O)[N+](=O)[O-])SC1=O

InChI

InChI=1S/C14H14N2O5S/c1-2-3-6-15-13(18)12(22-14(15)19)8-9-4-5-11(17)10(7-9)16(20)21/h4-5,7-8,17H,2-3,6H2,1H3