1-[2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)ethyl]pyrrolidin-1-ium

Systemtic Name: 1-[2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)ethyl]pyrrolidin-1-ium Openeye Name: 1-[2-(2-bromo-6-chloro-4-methyl-phenoxy)ethyl]pyrrolidin-1-ium CAS Name: 1-[2-(2-bromo-6-chloro-4-methylphenoxy)ethyl]pyrrolidin-1-ium IUPAC Name: 1-[2-(2-bromo-6-chloro-4-methylphenoxy)ethyl]pyrrolidin-1-ium Traditional Name: 1-[2-(2-bromo-6-chloro-4-methyl-phenoxy)ethyl]pyrrolidin-1-ium Formula: C13H18BrClNO+ MolecularWeight: 319.64512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17BrClNO/c1-10-8-11(14)13(12(15)9-10)17-7-6-16-4-2-3-5-16/h8-9H,2-7H2,1H3/p+1