4-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]benzoic acid hydrobromide

Systemtic Name: 4-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]benzoic acid hydrobromide Openeye Name: 4-[[4-(3-nitrophenyl)thiazol-2-yl]amino]benzoic acid hydrobromide CAS Name: 4-[[4-(3-nitrophenyl)-2-thiazolyl]amino]benzoic acid hydrobromide IUPAC Name: 4-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]benzoic acid hydrobromide Traditional Name: 4-[[4-(3-nitrophenyl)thiazol-2-yl]amino]benzoic acid hydrobromide Formula: C16H12BrN3O4S MolecularWeight: 422.25318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)NC3=CC=C(C=C3)C(=O)O.Br

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)NC3=CC=C(C=C3)C(=O)O.Br

InChI

InChI=1S/C16H11N3O4S.BrH/c20-15(21)10-4-6-12(7-5-10)17-16-18-14(9-24-16)11-2-1-3-13(8-11)19(22)23;/h1-9H,(H,17,18)(H,20,21);1H