butyl 2-sulfamoyl-1,3-benzothiazole-6-sulfonate

Systemtic Name: butyl 2-sulfamoyl-1,3-benzothiazole-6-sulfonate Openeye Name: butyl 2-sulfamoyl-1,3-benzothiazole-6-sulfonate CAS Name: 2-sulfamoyl-1,3-benzothiazole-6-sulfonic acid butyl ester IUPAC Name: butyl 2-sulfamoyl-1,3-benzothiazole-6-sulfonate Traditional Name: 2-sulfamoyl-1,3-benzothiazole-6-sulfonic acid butyl ester Formula: C11H14N2O5S3 MolecularWeight: 350.43426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)S(=O)(=O)N

Isomeric SMILES

CCCCOS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)S(=O)(=O)N

InChI

InChI=1S/C11H14N2O5S3/c1-2-3-6-18-21(16,17)8-4-5-9-10(7-8)19-11(13-9)20(12,14)15/h4-5,7H,2-3,6H2,1H3,(H2,12,14,15)