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

Systemtic Name: 3-[[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid Openeye Name: 3-[[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid CAS Name: 3-[[3-chloro-4-(2-oxo-1-pyrrolidinyl)phenyl]sulfamoyl]-4,5-dimethylbenzoic acid IUPAC Name: 3-[[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]sulfamoyl]-4,5-dimethylbenzoic acid Traditional Name: 3-[[3-chloro-4-(2-ketopyrrolidino)phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C19H19ClN2O5S MolecularWeight: 422.88256

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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)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClN2O5S/c1-11-8-13(19(24)25)9-17(12(11)2)28(26,27)21-14-5-6-16(15(20)10-14)22-7-3-4-18(22)23/h5-6,8-10,21H,3-4,7H2,1-2H3,(H,24,25)