3-[[2-[(2S)-butan-2-yl]phenyl]sulfamoyl]-4-methyl-benzoate

Systemtic Name: 3-[[2-[(2S)-butan-2-yl]phenyl]sulfamoyl]-4-methyl-benzoate Openeye Name: 4-methyl-3-[[2-[(1S)-1-methylpropyl]phenyl]sulfamoyl]benzoate CAS Name: 3-[[2-[(2S)-butan-2-yl]phenyl]sulfamoyl]-4-methylbenzoate IUPAC Name: 3-[[2-[(2S)-butan-2-yl]phenyl]sulfamoyl]-4-methylbenzoate Traditional Name: 4-methyl-3-[[2-[(1S)-1-methylpropyl]phenyl]sulfamoyl]benzoate Formula: C18H20NO4S- MolecularWeight: 346.4207

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)C(=O)[O-])C

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)C(=O)[O-])C

InChI

InChI=1S/C18H21NO4S/c1-4-12(2)15-7-5-6-8-16(15)19-24(22,23)17-11-14(18(20)21)10-9-13(17)3/h5-12,19H,4H2,1-3H3,(H,20,21)/p-1/t12-/m0/s1