3-[[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]sulfamoyl]-4-methoxy-benzoic acid

Systemtic Name: 3-[[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]sulfamoyl]-4-methoxy-benzoic acid Openeye Name: 4-methoxy-3-[[2-[[(1S)-1-methylpropyl]carbamoyl]phenyl]sulfamoyl]benzoic acid CAS Name: 3-[[2-[[[(2S)-butan-2-yl]amino]-oxomethyl]phenyl]sulfamoyl]-4-methoxybenzoic acid IUPAC Name: 3-[[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]sulfamoyl]-4-methoxybenzoic acid Traditional Name: 4-methoxy-3-[[2-[[(1S)-1-methylpropyl]carbamoyl]phenyl]sulfamoyl]benzoic acid Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O6S/c1-4-12(2)20-18(22)14-7-5-6-8-15(14)21-28(25,26)17-11-13(19(23)24)9-10-16(17)27-3/h5-12,21H,4H2,1-3H3,(H,20,22)(H,23,24)/t12-/m0/s1