(4-cyanophenyl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate

Systemtic Name: (4-cyanophenyl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate Openeye Name: (4-cyanophenyl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-acetamidophenyl)sulfonylamino]propanoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-acetamidophenyl)sulfonylamino]propionic acid (4-cyanobenzyl) ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H19N3O5S/c1-14(23)22-17-6-8-18(9-7-17)28(25,26)21-11-10-19(24)27-13-16-4-2-15(12-20)3-5-16/h2-9,21H,10-11,13H2,1H3,(H,22,23)