5-[[4-[(2S)-butan-2-yl]phenyl]sulfamoyl]-2-fluoranyl-benzoate

Systemtic Name: 5-[[4-[(2S)-butan-2-yl]phenyl]sulfamoyl]-2-fluoranyl-benzoate Openeye Name: 2-fluoro-5-[[4-[(1S)-1-methylpropyl]phenyl]sulfamoyl]benzoate CAS Name: 5-[[4-[(2S)-butan-2-yl]phenyl]sulfamoyl]-2-fluorobenzoate IUPAC Name: 5-[[4-[(2S)-butan-2-yl]phenyl]sulfamoyl]-2-fluorobenzoate Traditional Name: 2-fluoro-5-[[4-[(1S)-1-methylpropyl]phenyl]sulfamoyl]benzoate Formula: C17H17FNO4S- MolecularWeight: 350.384583

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)F)C(=O)[O-]

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)F)C(=O)[O-]

InChI

InChI=1S/C17H18FNO4S/c1-3-11(2)12-4-6-13(7-5-12)19-24(22,23)14-8-9-16(18)15(10-14)17(20)21/h4-11,19H,3H2,1-2H3,(H,20,21)/p-1/t11-/m0/s1