3-[[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]sulfamoyl]benzoic acid

Systemtic Name: 3-[[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]sulfamoyl]benzoic acid Openeye Name: 3-[[2-[[(1S)-1-methylpropyl]carbamoyl]phenyl]sulfamoyl]benzoic acid CAS Name: 3-[[2-[[[(2S)-butan-2-yl]amino]-oxomethyl]phenyl]sulfamoyl]benzoic acid IUPAC Name: 3-[[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]sulfamoyl]benzoic acid Traditional Name: 3-[[2-[[(1S)-1-methylpropyl]carbamoyl]phenyl]sulfamoyl]benzoic acid Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O5S/c1-3-12(2)19-17(21)15-9-4-5-10-16(15)20-26(24,25)14-8-6-7-13(11-14)18(22)23/h4-12,20H,3H2,1-2H3,(H,19,21)(H,22,23)/t12-/m0/s1