2-[[(5Z)-5-[(5-nitro-2-oxidanyl-phenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoic acid

Systemtic Name: 2-[[(5Z)-5-[(5-nitro-2-oxidanyl-phenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 2-[[(5Z)-5-[(2-hydroxy-5-nitro-phenyl)methylene]-4-oxo-thiazol-2-yl]amino]benzoic acid CAS Name: 2-[[(5Z)-5-[(2-hydroxy-5-nitrophenyl)methylidene]-4-oxo-2-thiazolyl]amino]benzoic acid IUPAC Name: 2-[[(5Z)-5-[(2-hydroxy-5-nitrophenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 2-[[(5Z)-5-(2-hydroxy-5-nitro-benzylidene)-4-keto-2-thiazolin-2-yl]amino]benzoic acid Formula: C17H11N3O6S MolecularWeight: 385.35074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC2=NC(=O)C(=CC3=C(C=CC(=C3)[N+](=O)[O-])O)S2

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC2=NC(=O)/C(=C/C3=C(C=CC(=C3)[N+](=O)[O-])O)/S2

InChI

InChI=1S/C17H11N3O6S/c21-13-6-5-10(20(25)26)7-9(13)8-14-15(22)19-17(27-14)18-12-4-2-1-3-11(12)16(23)24/h1-8,21H,(H,23,24)(H,18,19,22)/b14-8-