2-[[3-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]sulfonylamino]benzoic acid

Systemtic Name: 2-[[3-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]sulfonylamino]benzoic acid Openeye Name: 2-[[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]sulfonylamino]benzoic acid CAS Name: 2-[[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]sulfonylamino]benzoic acid IUPAC Name: 2-[[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]sulfonylamino]benzoic acid Traditional Name: 2-[[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]sulfonylamino]benzoic acid Formula: C20H13ClN2O5S MolecularWeight: 428.84562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC=CC(=C2)C3=NC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC=CC(=C2)C3=NC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C20H13ClN2O5S/c21-13-8-9-18-17(11-13)22-19(28-18)12-4-3-5-14(10-12)29(26,27)23-16-7-2-1-6-15(16)20(24)25/h1-11,23H,(H,24,25)