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2-[2-(2-tert-butyl-4-chloranyl-phenoxy)ethoxy]ethyl-(phenylmethyl)azanium

2-[2-(2-tert-butyl-4-chloranyl-phenoxy)ethoxy]ethyl-(phenylmethyl)azanium

Systemtic Name:2-[2-(2-tert-butyl-4-chloranyl-phenoxy)ethoxy]ethyl-(phenylmethyl)azanium
Openeye Name:benzyl-[2-[2-(2-tert-butyl-4-chloro-phenoxy)ethoxy]ethyl]ammonium
CAS Name:2-[2-(2-tert-butyl-4-chlorophenoxy)ethoxy]ethyl-(phenylmethyl)ammonium
IUPAC Name:benzyl-[2-[2-(2-tert-butyl-4-chlorophenoxy)ethoxy]ethyl]azanium
Traditional Name:benzyl-[2-[2-(2-tert-butyl-4-chloro-phenoxy)ethoxy]ethyl]ammonium
Formula: C21H29ClNO2+
MolecularWeight: 362.91346
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)Cl)OCCOCC[NH2+]CC2=CC=CC=C2


Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)Cl)OCCOCC[NH2+]CC2=CC=CC=C2


InChI

InChI=1S/C21H28ClNO2/c1-21(2,3)19-15-18(22)9-10-20(19)25-14-13-24-12-11-23-16-17-7-5-4-6-8-17/h4-10,15,23H,11-14,16H2,1-3H3/p+1


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