(2-benzamido-2-oxidanylidene-ethyl) 3-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 3-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (2-benzamido-2-oxo-ethyl) 3-(p-tolylsulfonylamino)propanoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]propanoic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 3-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(tosylamino)propionic acid (2-benzamido-2-keto-ethyl) ester Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC(=O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC(=O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H20N2O6S/c1-14-7-9-16(10-8-14)28(25,26)20-12-11-18(23)27-13-17(22)21-19(24)15-5-3-2-4-6-15/h2-10,20H,11-13H2,1H3,(H,21,22,24)