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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1NS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O)C(=O)O

InChI

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