5-[bis(2-hydroxyethyl)sulfamoyl]-2-methyl-benzoic acid

Systemtic Name: 5-[bis(2-hydroxyethyl)sulfamoyl]-2-methyl-benzoic acid Openeye Name: 5-[bis(2-hydroxyethyl)sulfamoyl]-2-methyl-benzoic acid CAS Name: 5-[bis(2-hydroxyethyl)sulfamoyl]-2-methylbenzoic acid IUPAC Name: 5-[bis(2-hydroxyethyl)sulfamoyl]-2-methylbenzoic acid Traditional Name: 5-[bis(2-hydroxyethyl)sulfamoyl]-2-methyl-benzoic acid Formula: C12H17NO6S MolecularWeight: 303.33148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(CCO)CCO)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(CCO)CCO)C(=O)O

InChI

InChI=1S/C12H17NO6S/c1-9-2-3-10(8-11(9)12(16)17)20(18,19)13(4-6-14)5-7-15/h2-3,8,14-15H,4-7H2,1H3,(H,16,17)