4-chloranyl-3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]benzoate

Systemtic Name: 4-chloranyl-3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]benzoate Openeye Name: 4-chloro-3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]benzoate CAS Name: 4-chloro-3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]benzoate IUPAC Name: 4-chloro-3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]benzoate Traditional Name: 4-chloro-3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]benzoate Formula: C16H12ClN2O5S2- MolecularWeight: 411.85988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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