2-[2-(2-bromanyl-4,6-dimethyl-phenoxy)ethoxy]ethyl-(phenylmethyl)azanium

Systemtic Name: 2-[2-(2-bromanyl-4,6-dimethyl-phenoxy)ethoxy]ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[2-(2-bromo-4,6-dimethyl-phenoxy)ethoxy]ethyl]ammonium CAS Name: 2-[2-(2-bromo-4,6-dimethylphenoxy)ethoxy]ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[2-(2-bromo-4,6-dimethylphenoxy)ethoxy]ethyl]azanium Traditional Name: benzyl-[2-[2-(2-bromo-4,6-dimethyl-phenoxy)ethoxy]ethyl]ammonium Formula: C19H25BrNO2+ MolecularWeight: 379.3113

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCOCC[NH2+]CC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCOCC[NH2+]CC2=CC=CC=C2)C

InChI

InChI=1S/C19H24BrNO2/c1-15-12-16(2)19(18(20)13-15)23-11-10-22-9-8-21-14-17-6-4-3-5-7-17/h3-7,12-13,21H,8-11,14H2,1-2H3/p+1