4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfonylbenzoic acid

Systemtic Name: 4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfonylbenzoic acid Openeye Name: 4-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfonylbenzoic acid CAS Name: 4-[2-oxo-2-(1-pyrrolidinyl)ethyl]sulfonylbenzoic acid IUPAC Name: 4-(2-oxo-2-pyrrolidin-1-ylethyl)sulfonylbenzoic acid Traditional Name: 4-(2-keto-2-pyrrolidino-ethyl)sulfonylbenzoic acid Formula: C13H15NO5S MolecularWeight: 297.3269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CS(=O)(=O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CCN(C1)C(=O)CS(=O)(=O)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H15NO5S/c15-12(14-7-1-2-8-14)9-20(18,19)11-5-3-10(4-6-11)13(16)17/h3-6H,1-2,7-9H2,(H,16,17)