3-[[(2S)-butan-2-yl]sulfamoyl]-4,5-dimethyl-benzoate

Systemtic Name: 3-[[(2S)-butan-2-yl]sulfamoyl]-4,5-dimethyl-benzoate Openeye Name: 3,4-dimethyl-5-[[(1S)-1-methylpropyl]sulfamoyl]benzoate CAS Name: 3-[[(2S)-butan-2-yl]sulfamoyl]-4,5-dimethylbenzoate IUPAC Name: 3-[[(2S)-butan-2-yl]sulfamoyl]-4,5-dimethylbenzoate Traditional Name: 3,4-dimethyl-5-[[(1S)-1-methylpropyl]sulfamoyl]benzoate Formula: C13H18NO4S- MolecularWeight: 284.35132

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC(=CC(=C1C)C)C(=O)[O-]

Isomeric SMILES

CC[C@H](C)NS(=O)(=O)C1=CC(=CC(=C1C)C)C(=O)[O-]

InChI

InChI=1S/C13H19NO4S/c1-5-9(3)14-19(17,18)12-7-11(13(15)16)6-8(2)10(12)4/h6-7,9,14H,5H2,1-4H3,(H,15,16)/p-1/t9-/m0/s1