(5-oxidanyl-1,2-benzothiazol-3-yl) 2-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: (5-oxidanyl-1,2-benzothiazol-3-yl) 2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (5-hydroxy-1,2-benzothiazol-3-yl) 2-(p-tolylsulfonylamino)propanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]propanoic acid (5-hydroxy-1,2-benzothiazol-3-yl) ester IUPAC Name: (5-hydroxy-1,2-benzothiazol-3-yl) 2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 2-(tosylamino)propionic acid (5-hydroxy-1,2-benzothiazol-3-yl) ester Formula: C17H16N2O5S2 MolecularWeight: 392.44934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OC2=NSC3=C2C=C(C=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OC2=NSC3=C2C=C(C=C3)O

InChI

InChI=1S/C17H16N2O5S2/c1-10-3-6-13(7-4-10)26(22,23)19-11(2)17(21)24-16-14-9-12(20)5-8-15(14)25-18-16/h3-9,11,19-20H,1-2H3