2-acetamido-4-(2-hydroxyethylsulfonyl)benzoic acid

Systemtic Name: 2-acetamido-4-(2-hydroxyethylsulfonyl)benzoic acid Openeye Name: 2-acetamido-4-(2-hydroxyethylsulfonyl)benzoic acid CAS Name: 2-acetamido-4-(2-hydroxyethylsulfonyl)benzoic acid IUPAC Name: 2-acetamido-4-(2-hydroxyethylsulfonyl)benzoic acid Traditional Name: 2-acetamido-4-(2-hydroxyethylsulfonyl)benzoic acid Formula: C11H13NO6S MolecularWeight: 287.28902

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)CCO)C(=O)O

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)CCO)C(=O)O

InChI

InChI=1S/C11H13NO6S/c1-7(14)12-10-6-8(19(17,18)5-4-13)2-3-9(10)11(15)16/h2-3,6,13H,4-5H2,1H3,(H,12,14)(H,15,16)