3,4-dimethyl-5-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 3,4-dimethyl-5-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfamoyl]benzoic acid Openeye Name: 3,4-dimethyl-5-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfamoyl]benzoic acid CAS Name: 3,4-dimethyl-5-[[4-(2-oxo-1-pyrrolidinyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 3,4-dimethyl-5-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfamoyl]benzoic acid Traditional Name: 3-[[4-(2-ketopyrrolidino)phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O5S/c1-12-10-14(19(23)24)11-17(13(12)2)27(25,26)20-15-5-7-16(8-6-15)21-9-3-4-18(21)22/h5-8,10-11,20H,3-4,9H2,1-2H3,(H,23,24)