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

Systemtic Name: 2-[(4-methylsulfonylphenyl)sulfonylamino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[(4-methylsulfonylphenyl)sulfonylamino]propanoic acid CAS Name: 3-hydroxy-2-[(4-methylsulfonylphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-hydroxy-2-[(4-methylsulfonylphenyl)sulfonylamino]propanoic acid Traditional Name: 3-hydroxy-2-[(4-mesylphenyl)sulfonylamino]propionic acid Formula: C10H13NO7S2 MolecularWeight: 323.34272

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC(CO)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC(CO)C(=O)O

InChI

InChI=1S/C10H13NO7S2/c1-19(15,16)7-2-4-8(5-3-7)20(17,18)11-9(6-12)10(13)14/h2-5,9,11-12H,6H2,1H3,(H,13,14)