3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenoxy]sulfonylbenzoic acid

Systemtic Name: 3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenoxy]sulfonylbenzoic acid Openeye Name: 3-[4-(2-oxopyrrolidin-1-yl)phenoxy]sulfonylbenzoic acid CAS Name: 3-[4-(2-oxo-1-pyrrolidinyl)phenoxy]sulfonylbenzoic acid IUPAC Name: 3-[4-(2-oxopyrrolidin-1-yl)phenoxy]sulfonylbenzoic acid Traditional Name: 3-[4-(2-ketopyrrolidino)phenoxy]sulfonylbenzoic acid Formula: C17H15NO6S MolecularWeight: 361.3691

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C17H15NO6S/c19-16-5-2-10-18(16)13-6-8-14(9-7-13)24-25(22,23)15-4-1-3-12(11-15)17(20)21/h1,3-4,6-9,11H,2,5,10H2,(H,20,21)