1-[2-(4-chloranyl-2-methyl-phenoxy)ethyl]pyrrolidin-1-ium

Systemtic Name: 1-[2-(4-chloranyl-2-methyl-phenoxy)ethyl]pyrrolidin-1-ium Openeye Name: 1-[2-(4-chloro-2-methyl-phenoxy)ethyl]pyrrolidin-1-ium CAS Name: 1-[2-(4-chloro-2-methylphenoxy)ethyl]pyrrolidin-1-ium IUPAC Name: 1-[2-(4-chloro-2-methylphenoxy)ethyl]pyrrolidin-1-ium Traditional Name: 1-[2-(4-chloro-2-methyl-phenoxy)ethyl]pyrrolidin-1-ium Formula: C13H19ClNO+ MolecularWeight: 240.74906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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