2-methyl-5-(3-methylbutylsulfamoyl)benzoate

Systemtic Name: 2-methyl-5-(3-methylbutylsulfamoyl)benzoate Openeye Name: 5-(isopentylsulfamoyl)-2-methyl-benzoate CAS Name: 2-methyl-5-(3-methylbutylsulfamoyl)benzoate IUPAC Name: 2-methyl-5-(3-methylbutylsulfamoyl)benzoate Traditional Name: 5-(isoamylsulfamoyl)-2-methyl-benzoate Formula: C13H18NO4S- MolecularWeight: 284.35132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(C)C)C(=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(C)C)C(=O)[O-]

InChI

InChI=1S/C13H19NO4S/c1-9(2)6-7-14-19(17,18)11-5-4-10(3)12(8-11)13(15)16/h4-5,8-9,14H,6-7H2,1-3H3,(H,15,16)/p-1