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

Systemtic Name: 3-[[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]sulfamoyl]-4-methyl-benzoate Openeye Name: 4-methyl-3-[[2-[[(1S)-1-methylpropyl]carbamoyl]phenyl]sulfamoyl]benzoate CAS Name: 3-[[2-[[[(2S)-butan-2-yl]amino]-oxomethyl]phenyl]sulfamoyl]-4-methylbenzoate IUPAC Name: 3-[[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]sulfamoyl]-4-methylbenzoate Traditional Name: 4-methyl-3-[[2-[[(1S)-1-methylpropyl]carbamoyl]phenyl]sulfamoyl]benzoate Formula: C19H21N2O5S- MolecularWeight: 389.44544

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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-])C

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O5S/c1-4-13(3)20-18(22)15-7-5-6-8-16(15)21-27(25,26)17-11-14(19(23)24)10-9-12(17)2/h5-11,13,21H,4H2,1-3H3,(H,20,22)(H,23,24)/p-1/t13-/m0/s1