1-[2-(2-chloranyl-5-methyl-phenoxy)ethyl]pyrrolidin-1-ium

Systemtic Name: 1-[2-(2-chloranyl-5-methyl-phenoxy)ethyl]pyrrolidin-1-ium Openeye Name: 1-[2-(2-chloro-5-methyl-phenoxy)ethyl]pyrrolidin-1-ium CAS Name: 1-[2-(2-chloro-5-methylphenoxy)ethyl]pyrrolidin-1-ium IUPAC Name: 1-[2-(2-chloro-5-methylphenoxy)ethyl]pyrrolidin-1-ium Traditional Name: 1-[2-(2-chloro-5-methyl-phenoxy)ethyl]pyrrolidin-1-ium Formula: C13H19ClNO+ MolecularWeight: 240.74906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OCC[NH+]2CCCC2

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OCC[NH+]2CCCC2

InChI

InChI=1S/C13H18ClNO/c1-11-4-5-12(14)13(10-11)16-9-8-15-6-2-3-7-15/h4-5,10H,2-3,6-9H2,1H3/p+1