[1-(diphenylmethyl)azetidin-1-ium-3-yl] methanesulfonate

Systemtic Name: [1-(diphenylmethyl)azetidin-1-ium-3-yl] methanesulfonate Openeye Name: (1-benzhydrylazetidin-1-ium-3-yl) methanesulfonate CAS Name: methanesulfonic acid [1-(diphenylmethyl)-3-azetidin-1-iumyl] ester IUPAC Name: (1-benzhydrylazetidin-1-ium-3-yl) methanesulfonate Traditional Name: methanesulfonic acid (1-benzhydrylazetidin-1-ium-3-yl) ester Formula: C17H20NO3S+ MolecularWeight: 318.4106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1C[NH+](C1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)OC1C[NH+](C1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H19NO3S/c1-22(19,20)21-16-12-18(13-16)17(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16-17H,12-13H2,1H3/p+1