4-methyl-3-(pentylsulfamoyl)benzoate

Systemtic Name: 4-methyl-3-(pentylsulfamoyl)benzoate Openeye Name: 4-methyl-3-(pentylsulfamoyl)benzoate CAS Name: 4-methyl-3-(pentylsulfamoyl)benzoate IUPAC Name: 4-methyl-3-(pentylsulfamoyl)benzoate Traditional Name: 3-(amylsulfamoyl)-4-methyl-benzoate Formula: C13H18NO4S- MolecularWeight: 284.35132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNS(=O)(=O)C1=C(C=CC(=C1)C(=O)[O-])C

Isomeric SMILES

CCCCCNS(=O)(=O)C1=C(C=CC(=C1)C(=O)[O-])C

InChI

InChI=1S/C13H19NO4S/c1-3-4-5-8-14-19(17,18)12-9-11(13(15)16)7-6-10(12)2/h6-7,9,14H,3-5,8H2,1-2H3,(H,15,16)/p-1