1,2,2-trimethyl-1-(phenylmethyl)azetidin-1-ium perchlorate

Systemtic Name: 1,2,2-trimethyl-1-(phenylmethyl)azetidin-1-ium perchlorate Openeye Name: 1-benzyl-1,2,2-trimethyl-azetidin-1-ium perchlorate CAS Name: 1,2,2-trimethyl-1-(phenylmethyl)azetidin-1-ium perchlorate IUPAC Name: 1-benzyl-1,2,2-trimethylazetidin-1-ium perchlorate Traditional Name: 1-benzyl-1,2,2-trimethyl-azetidin-1-ium perchlorate Formula: C13H20ClNO4 MolecularWeight: 289.7552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC[N+]1(C)CC2=CC=CC=C2)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1(CC[N+]1(C)CC2=CC=CC=C2)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C13H20N.ClHO4/c1-13(2)9-10-14(13,3)11-12-7-5-4-6-8-12;2-1(3,4)5/h4-8H,9-11H2,1-3H3;(H,2,3,4,5)/q+1;/p-1