cyanomethyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate

Systemtic Name: cyanomethyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate Openeye Name: cyanomethyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-acetamidophenyl)sulfonylamino]propanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-acetamidophenyl)sulfonylamino]propionic acid cyanomethyl ester Formula: C13H15N3O5S MolecularWeight: 325.3403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O5S/c1-10(17)16-11-2-4-12(5-3-11)22(19,20)15-8-6-13(18)21-9-7-14/h2-5,15H,6,8-9H2,1H3,(H,16,17)