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

Systemtic Name: 5-[(3-nitro-2-oxidanyl-phenyl)methylidene]-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-1,3-thiazolidine-2,4-dione Openeye Name: 5-[(2-hydroxy-3-nitro-phenyl)methylene]-3-[2-oxo-2-(1-piperidyl)ethyl]thiazolidine-2,4-dione CAS Name: 5-[(2-hydroxy-3-nitrophenyl)methylidene]-3-[2-oxo-2-(1-piperidinyl)ethyl]thiazolidine-2,4-dione IUPAC Name: 5-[(2-hydroxy-3-nitrophenyl)methylidene]-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazolidine-2,4-dione Traditional Name: 5-(2-hydroxy-3-nitro-benzylidene)-3-(2-keto-2-piperidino-ethyl)thiazolidine-2,4-quinone Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O6S/c21-14(18-7-2-1-3-8-18)10-19-16(23)13(27-17(19)24)9-11-5-4-6-12(15(11)22)20(25)26/h4-6,9,22H,1-3,7-8,10H2