3-[methyl(oxan-4-yl)sulfamoyl]benzoic acid

Systemtic Name: 3-[methyl(oxan-4-yl)sulfamoyl]benzoic acid Openeye Name: 3-[methyl(tetrahydropyran-4-yl)sulfamoyl]benzoic acid CAS Name: 3-[methyl(4-oxanyl)sulfamoyl]benzoic acid IUPAC Name: 3-[methyl(oxan-4-yl)sulfamoyl]benzoic acid Traditional Name: 3-[methyl(tetrahydropyran-4-yl)sulfamoyl]benzoic acid Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCOCC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CN(C1CCOCC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C13H17NO5S/c1-14(11-5-7-19-8-6-11)20(17,18)12-4-2-3-10(9-12)13(15)16/h2-4,9,11H,5-8H2,1H3,(H,15,16)