methyl 2-(3-oxidanylpropylsulfonyl)-5-sulfamoyl-benzoate

Systemtic Name: methyl 2-(3-oxidanylpropylsulfonyl)-5-sulfamoyl-benzoate Openeye Name: methyl 2-(3-hydroxypropylsulfonyl)-5-sulfamoyl-benzoate CAS Name: 2-(3-hydroxypropylsulfonyl)-5-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 2-(3-hydroxypropylsulfonyl)-5-sulfamoylbenzoate Traditional Name: 2-(3-hydroxypropylsulfonyl)-5-sulfamoyl-benzoic acid methyl ester Formula: C11H15NO7S2 MolecularWeight: 337.3693

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)S(=O)(=O)CCCO

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)S(=O)(=O)CCCO

InChI

InChI=1S/C11H15NO7S2/c1-19-11(14)9-7-8(21(12,17)18)3-4-10(9)20(15,16)6-2-5-13/h3-4,7,13H,2,5-6H2,1H3,(H2,12,17,18)