3-fluoranyl-4-methyl-5-(pentan-2-ylsulfamoyl)benzoic acid

Systemtic Name: 3-fluoranyl-4-methyl-5-(pentan-2-ylsulfamoyl)benzoic acid Openeye Name: 3-fluoro-4-methyl-5-(1-methylbutylsulfamoyl)benzoic acid CAS Name: 3-fluoro-4-methyl-5-(pentan-2-ylsulfamoyl)benzoic acid IUPAC Name: 3-fluoro-4-methyl-5-(pentan-2-ylsulfamoyl)benzoic acid Traditional Name: 3-fluoro-4-methyl-5-(1-methylbutylsulfamoyl)benzoic acid Formula: C13H18FNO4S MolecularWeight: 303.349723

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NS(=O)(=O)C1=CC(=CC(=C1C)F)C(=O)O

Isomeric SMILES

CCCC(C)NS(=O)(=O)C1=CC(=CC(=C1C)F)C(=O)O

InChI

InChI=1S/C13H18FNO4S/c1-4-5-8(2)15-20(18,19)12-7-10(13(16)17)6-11(14)9(12)3/h6-8,15H,4-5H2,1-3H3,(H,16,17)