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

Systemtic Name: 4-[4-(2-oxidanylidenepyrrolidin-1-yl)phenoxy]sulfonylbenzoic acid Openeye Name: 4-[4-(2-oxopyrrolidin-1-yl)phenoxy]sulfonylbenzoic acid CAS Name: 4-[4-(2-oxo-1-pyrrolidinyl)phenoxy]sulfonylbenzoic acid IUPAC Name: 4-[4-(2-oxopyrrolidin-1-yl)phenoxy]sulfonylbenzoic acid Traditional Name: 4-[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=C(C=C3)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C17H15NO6S/c19-16-2-1-11-18(16)13-5-7-14(8-6-13)24-25(22,23)15-9-3-12(4-10-15)17(20)21/h3-10H,1-2,11H2,(H,20,21)