1,3-benzothiazol-5-yl 2-sulfamoyloctanoate

Systemtic Name: 1,3-benzothiazol-5-yl 2-sulfamoyloctanoate Openeye Name: 1,3-benzothiazol-5-yl 2-sulfamoyloctanoate CAS Name: 2-sulfamoyloctanoic acid 1,3-benzothiazol-5-yl ester IUPAC Name: 1,3-benzothiazol-5-yl 2-sulfamoyloctanoate Traditional Name: 2-sulfamoylcaprylic acid 1,3-benzothiazol-5-yl ester Formula: C15H20N2O4S2 MolecularWeight: 356.4603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)OC1=CC2=C(C=C1)SC=N2)S(=O)(=O)N

Isomeric SMILES

CCCCCCC(C(=O)OC1=CC2=C(C=C1)SC=N2)S(=O)(=O)N

InChI

InChI=1S/C15H20N2O4S2/c1-2-3-4-5-6-14(23(16,19)20)15(18)21-11-7-8-13-12(9-11)17-10-22-13/h7-10,14H,2-6H2,1H3,(H2,16,19,20)