3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]propanoate

Systemtic Name: 3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]propanoate Openeye Name: 3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]propanoate CAS Name: 3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]propanoate IUPAC Name: 3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]propanoate Traditional Name: 3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]propionate Formula: C12H13N2O5S2- MolecularWeight: 329.37202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)CCC(=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)CCC(=O)[O-]

InChI

InChI=1S/C12H14N2O5S2/c1-2-19-8-3-4-9-10(7-8)20-12(13-9)14-21(17,18)6-5-11(15)16/h3-4,7H,2,5-6H2,1H3,(H,13,14)(H,15,16)/p-1