3-[[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 3-[[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfamoyl]benzoic acid Openeye Name: 3-[[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]sulfamoyl]benzoic acid CAS Name: 3-[[3-methyl-4-(2-oxo-1-pyrrolidinyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 3-[[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]sulfamoyl]benzoic acid Traditional Name: 3-[[4-(2-ketopyrrolidino)-3-methyl-phenyl]sulfamoyl]benzoic acid Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)O)N3CCCC3=O

Isomeric SMILES

CC1=C(C=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)O)N3CCCC3=O

InChI

InChI=1S/C18H18N2O5S/c1-12-10-14(7-8-16(12)20-9-3-6-17(20)21)19-26(24,25)15-5-2-4-13(11-15)18(22)23/h2,4-5,7-8,10-11,19H,3,6,9H2,1H3,(H,22,23)