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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=CC(=C2)N3CCCC3=O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=CC(=C2)N3CCCC3=O

InChI

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