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

Systemtic Name: 3-[[(5Z)-5-[(2-nitrophenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 3-[[(5Z)-5-[(2-nitrophenyl)methylene]-4-oxo-thiazol-2-yl]amino]benzoic acid CAS Name: 3-[[(5Z)-5-[(2-nitrophenyl)methylidene]-4-oxo-2-thiazolyl]amino]benzoic acid IUPAC Name: 3-[[(5Z)-5-[(2-nitrophenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 3-[[(5Z)-4-keto-5-(2-nitrobenzylidene)-2-thiazolin-2-yl]amino]benzoic acid Formula: C17H11N3O5S MolecularWeight: 369.35134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C2C(=O)N=C(S2)NC3=CC=CC(=C3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)/C=C\2/C(=O)N=C(S2)NC3=CC=CC(=C3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C17H11N3O5S/c21-15-14(9-10-4-1-2-7-13(10)20(24)25)26-17(19-15)18-12-6-3-5-11(8-12)16(22)23/h1-9H,(H,22,23)(H,18,19,21)/b14-9-