2-[(4-methylsulfonylphenyl)sulfonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[(4-methylsulfonylphenyl)sulfonylamino]-3-oxidanyl-butanoic acid Openeye Name: 3-hydroxy-2-[(4-methylsulfonylphenyl)sulfonylamino]butanoic acid CAS Name: 3-hydroxy-2-[(4-methylsulfonylphenyl)sulfonylamino]butanoic acid IUPAC Name: 3-hydroxy-2-[(4-methylsulfonylphenyl)sulfonylamino]butanoic acid Traditional Name: 3-hydroxy-2-[(4-mesylphenyl)sulfonylamino]butyric acid Formula: C11H15NO7S2 MolecularWeight: 337.3693

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)C)O

Isomeric SMILES

CC(C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)C)O

InChI

InChI=1S/C11H15NO7S2/c1-7(13)10(11(14)15)12-21(18,19)9-5-3-8(4-6-9)20(2,16)17/h3-7,10,12-13H,1-2H3,(H,14,15)