2-chloranyl-5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid

Systemtic Name: 2-chloranyl-5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid Openeye Name: 2-chloro-5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid CAS Name: 2-chloro-5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid IUPAC Name: 2-chloro-5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid Traditional Name: 2-chloro-5-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]benzoic acid Formula: C16H13ClN2O5S2 MolecularWeight: 412.86782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C16H13ClN2O5S2/c1-2-24-9-3-6-13-14(7-9)25-16(18-13)19-26(22,23)10-4-5-12(17)11(8-10)15(20)21/h3-8H,2H2,1H3,(H,18,19)(H,20,21)