3-fluoranyl-4-methyl-5-[methyl(pentyl)sulfamoyl]benzoic acid

Systemtic Name: 3-fluoranyl-4-methyl-5-[methyl(pentyl)sulfamoyl]benzoic acid Openeye Name: 3-fluoro-4-methyl-5-[methyl(pentyl)sulfamoyl]benzoic acid CAS Name: 3-fluoro-4-methyl-5-[methyl(pentyl)sulfamoyl]benzoic acid IUPAC Name: 3-fluoro-4-methyl-5-[methyl(pentyl)sulfamoyl]benzoic acid Traditional Name: 3-[amyl(methyl)sulfamoyl]-5-fluoro-4-methyl-benzoic acid Formula: C14H20FNO4S MolecularWeight: 317.376303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C)S(=O)(=O)C1=CC(=CC(=C1C)F)C(=O)O

Isomeric SMILES

CCCCCN(C)S(=O)(=O)C1=CC(=CC(=C1C)F)C(=O)O

InChI

InChI=1S/C14H20FNO4S/c1-4-5-6-7-16(3)21(19,20)13-9-11(14(17)18)8-12(15)10(13)2/h8-9H,4-7H2,1-3H3,(H,17,18)