2-[(2-chloranyl-5-methylsulfonyl-phenyl)sulfonylamino]propanoic acid

Systemtic Name: 2-[(2-chloranyl-5-methylsulfonyl-phenyl)sulfonylamino]propanoic acid Openeye Name: 2-[(2-chloro-5-methylsulfonyl-phenyl)sulfonylamino]propanoic acid CAS Name: 2-[(2-chloro-5-methylsulfonylphenyl)sulfonylamino]propanoic acid IUPAC Name: 2-[(2-chloro-5-methylsulfonylphenyl)sulfonylamino]propanoic acid Traditional Name: 2-[(2-chloro-5-mesyl-phenyl)sulfonylamino]propionic acid Formula: C10H12ClNO6S2 MolecularWeight: 341.78838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12ClNO6S2/c1-6(10(13)14)12-20(17,18)9-5-7(19(2,15)16)3-4-8(9)11/h3-6,12H,1-2H3,(H,13,14)