2-oxidanylidene-2-phenylmethoxy-1-piperidin-3-yl-ethanesulfonic acid

Systemtic Name: 2-oxidanylidene-2-phenylmethoxy-1-piperidin-3-yl-ethanesulfonic acid Openeye Name: 2-benzyloxy-2-oxo-1-(3-piperidyl)ethanesulfonic acid CAS Name: 2-oxo-2-phenylmethoxy-1-(3-piperidinyl)ethanesulfonic acid IUPAC Name: 2-oxo-2-phenylmethoxy-1-piperidin-3-ylethanesulfonic acid Traditional Name: 2-benzoxy-2-keto-1-(3-piperidyl)ethanesulfonic acid Formula: C14H19NO5S MolecularWeight: 313.36936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C(C(=O)OCC2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

C1CC(CNC1)C(C(=O)OCC2=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C14H19NO5S/c16-14(20-10-11-5-2-1-3-6-11)13(21(17,18)19)12-7-4-8-15-9-12/h1-3,5-6,12-13,15H,4,7-10H2,(H,17,18,19)