4-cyano-2-[(4-methylphenyl)sulfonylamino]butanoic acid

Systemtic Name: 4-cyano-2-[(4-methylphenyl)sulfonylamino]butanoic acid Openeye Name: 4-cyano-2-(p-tolylsulfonylamino)butanoic acid CAS Name: 4-cyano-2-[(4-methylphenyl)sulfonylamino]butanoic acid IUPAC Name: 4-cyano-2-[(4-methylphenyl)sulfonylamino]butanoic acid Traditional Name: 4-cyano-2-(tosylamino)butyric acid Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCC#N)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCC#N)C(=O)O

InChI

InChI=1S/C12H14N2O4S/c1-9-4-6-10(7-5-9)19(17,18)14-11(12(15)16)3-2-8-13/h4-7,11,14H,2-3H2,1H3,(H,15,16)