4-methyl-3-(oxolan-2-ylmethylsulfamoyl)benzoic acid

Systemtic Name: 4-methyl-3-(oxolan-2-ylmethylsulfamoyl)benzoic acid Openeye Name: 4-methyl-3-(tetrahydrofuran-2-ylmethylsulfamoyl)benzoic acid CAS Name: 4-methyl-3-(2-oxolanylmethylsulfamoyl)benzoic acid IUPAC Name: 4-methyl-3-(oxolan-2-ylmethylsulfamoyl)benzoic acid Traditional Name: 4-methyl-3-(tetrahydrofurfurylsulfamoyl)benzoic acid Formula: C13H17NO5S MolecularWeight: 299.34278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NCC2CCCO2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NCC2CCCO2

InChI

InChI=1S/C13H17NO5S/c1-9-4-5-10(13(15)16)7-12(9)20(17,18)14-8-11-3-2-6-19-11/h4-5,7,11,14H,2-3,6,8H2,1H3,(H,15,16)