cyanomethyl 3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate

Systemtic Name: cyanomethyl 3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate Openeye Name: cyanomethyl 3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate CAS Name: 3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate Traditional Name: 3-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propionic acid cyanomethyl ester Formula: C15H20N2O4S MolecularWeight: 324.3953

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)NCCC(=O)OCC#N)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)NCCC(=O)OCC#N)C)C

InChI

InChI=1S/C15H20N2O4S/c1-10-9-11(2)13(4)15(12(10)3)22(19,20)17-7-5-14(18)21-8-6-16/h9,17H,5,7-8H2,1-4H3