4-(oxan-2-ylmethoxy)-3-sulfamoyl-benzoic acid

Systemtic Name: 4-(oxan-2-ylmethoxy)-3-sulfamoyl-benzoic acid Openeye Name: 3-sulfamoyl-4-(tetrahydropyran-2-ylmethoxy)benzoic acid CAS Name: 4-(2-oxanylmethoxy)-3-sulfamoylbenzoic acid IUPAC Name: 4-(oxan-2-ylmethoxy)-3-sulfamoylbenzoic acid Traditional Name: 3-sulfamoyl-4-(tetrahydropyran-2-ylmethoxy)benzoic acid Formula: C13H17NO6S MolecularWeight: 315.34218

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)COC2=C(C=C(C=C2)C(=O)O)S(=O)(=O)N

Isomeric SMILES

C1CCOC(C1)COC2=C(C=C(C=C2)C(=O)O)S(=O)(=O)N

InChI

InChI=1S/C13H17NO6S/c14-21(17,18)12-7-9(13(15)16)4-5-11(12)20-8-10-3-1-2-6-19-10/h4-5,7,10H,1-3,6,8H2,(H,15,16)(H2,14,17,18)