4-[(4-methylsulfonylphenyl)amino]butanoic acid

Systemtic Name: 4-[(4-methylsulfonylphenyl)amino]butanoic acid Openeye Name: 4-(4-methylsulfonylanilino)butanoic acid CAS Name: 4-(4-methylsulfonylanilino)butanoic acid IUPAC Name: 4-(4-methylsulfonylanilino)butanoic acid Traditional Name: 4-(4-mesylanilino)butyric acid Formula: C11H15NO4S MolecularWeight: 257.3061

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NCCCC(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NCCCC(=O)O

InChI

InChI=1S/C11H15NO4S/c1-17(15,16)10-6-4-9(5-7-10)12-8-2-3-11(13)14/h4-7,12H,2-3,8H2,1H3,(H,13,14)