3-fluoranyl-4-methyl-5-[propan-2-yl(propyl)sulfamoyl]benzoic acid

Systemtic Name: 3-fluoranyl-4-methyl-5-[propan-2-yl(propyl)sulfamoyl]benzoic acid Openeye Name: 3-fluoro-5-[isopropyl(propyl)sulfamoyl]-4-methyl-benzoic acid CAS Name: 3-fluoro-4-methyl-5-[propan-2-yl(propyl)sulfamoyl]benzoic acid IUPAC Name: 3-fluoro-4-methyl-5-[propan-2-yl(propyl)sulfamoyl]benzoic acid Traditional Name: 3-fluoro-5-[isopropyl(propyl)sulfamoyl]-4-methyl-benzoic acid Formula: C14H20FNO4S MolecularWeight: 317.376303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20FNO4S/c1-5-6-16(9(2)3)21(19,20)13-8-11(14(17)18)7-12(15)10(13)4/h7-9H,5-6H2,1-4H3,(H,17,18)