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

Systemtic Name: 3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 3-[[4-(3-nitrophenyl)thiazol-2-yl]amino]benzoic acid CAS Name: 3-[[4-(3-nitrophenyl)-2-thiazolyl]amino]benzoic acid IUPAC Name: 3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 3-[[4-(3-nitrophenyl)thiazol-2-yl]amino]benzoic acid Formula: C16H11N3O4S MolecularWeight: 341.34124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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