3-(azetidin-1-ylsulfonylmethyl)benzoic acid

Systemtic Name: 3-(azetidin-1-ylsulfonylmethyl)benzoic acid Openeye Name: 3-(azetidin-1-ylsulfonylmethyl)benzoic acid CAS Name: 3-(1-azetidinylsulfonylmethyl)benzoic acid IUPAC Name: 3-(azetidin-1-ylsulfonylmethyl)benzoic acid Traditional Name: 3-(azetidin-1-ylsulfonylmethyl)benzoic acid Formula: C11H13NO4S MolecularWeight: 255.29022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)S(=O)(=O)CC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

C1CN(C1)S(=O)(=O)CC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C11H13NO4S/c13-11(14)10-4-1-3-9(7-10)8-17(15,16)12-5-2-6-12/h1,3-4,7H,2,5-6,8H2,(H,13,14)