(5E)-2-(hydroxymethylamino)-5-[(4-nitrophenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: (5E)-2-(hydroxymethylamino)-5-[(4-nitrophenyl)methylidene]-1,3-thiazol-4-one Openeye Name: (5E)-2-(hydroxymethylamino)-5-[(4-nitrophenyl)methylene]thiazol-4-one CAS Name: (5E)-2-(hydroxymethylamino)-5-[(4-nitrophenyl)methylidene]-4-thiazolone IUPAC Name: (5E)-2-(hydroxymethylamino)-5-[(4-nitrophenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5E)-2-(methylolamino)-5-(4-nitrobenzylidene)-2-thiazolin-4-one Formula: C11H9N3O4S MolecularWeight: 279.27186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C2C(=O)N=C(S2)NCO)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C=C/2\C(=O)N=C(S2)NCO)[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O4S/c15-6-12-11-13-10(16)9(19-11)5-7-1-3-8(4-2-7)14(17)18/h1-5,15H,6H2,(H,12,13,16)/b9-5+