4-[(2-chloranyl-5-methylsulfonyl-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 4-[(2-chloranyl-5-methylsulfonyl-phenyl)sulfonylamino]butanoic acid Openeye Name: 4-[(2-chloro-5-methylsulfonyl-phenyl)sulfonylamino]butanoic acid CAS Name: 4-[(2-chloro-5-methylsulfonylphenyl)sulfonylamino]butanoic acid IUPAC Name: 4-[(2-chloro-5-methylsulfonylphenyl)sulfonylamino]butanoic acid Traditional Name: 4-[(2-chloro-5-mesyl-phenyl)sulfonylamino]butyric acid Formula: C11H14ClNO6S2 MolecularWeight: 355.81496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14ClNO6S2/c1-20(16,17)8-4-5-9(12)10(7-8)21(18,19)13-6-2-3-11(14)15/h4-5,7,13H,2-3,6H2,1H3,(H,14,15)