5-[(3-bromanyl-5-nitro-4-oxidanyl-phenyl)methylidene]-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[(3-bromanyl-5-nitro-4-oxidanyl-phenyl)methylidene]-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-1,3-thiazolidine-2,4-dione Openeye Name: 5-[(3-bromo-4-hydroxy-5-nitro-phenyl)methylene]-3-[2-oxo-2-(1-piperidyl)ethyl]thiazolidine-2,4-dione CAS Name: 5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-3-[2-oxo-2-(1-piperidinyl)ethyl]thiazolidine-2,4-dione IUPAC Name: 5-[(3-bromo-4-hydroxy-5-nitrophenyl)methylidene]-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazolidine-2,4-dione Traditional Name: 5-(3-bromo-4-hydroxy-5-nitro-benzylidene)-3-(2-keto-2-piperidino-ethyl)thiazolidine-2,4-quinone Formula: C17H16BrN3O6S MolecularWeight: 470.29444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2C(=O)C(=CC3=CC(=C(C(=C3)Br)O)[N+](=O)[O-])SC2=O

Isomeric SMILES

C1CCN(CC1)C(=O)CN2C(=O)C(=CC3=CC(=C(C(=C3)Br)O)[N+](=O)[O-])SC2=O

InChI

InChI=1S/C17H16BrN3O6S/c18-11-6-10(7-12(15(11)23)21(26)27)8-13-16(24)20(17(25)28-13)9-14(22)19-4-2-1-3-5-19/h6-8,23H,1-5,9H2