dimethyl-[(2-methylphenyl)methyl]-(3-oxidanylpropyl)azanium bromide

Systemtic Name: dimethyl-[(2-methylphenyl)methyl]-(3-oxidanylpropyl)azanium bromide Openeye Name: 3-hydroxypropyl-dimethyl-(o-tolylmethyl)ammonium bromide CAS Name: 3-hydroxypropyl-dimethyl-[(2-methylphenyl)methyl]ammonium bromide IUPAC Name: 3-hydroxypropyl-dimethyl-[(2-methylphenyl)methyl]azanium bromide Traditional Name: 3-hydroxypropyl-dimethyl-(2-methylbenzyl)ammonium bromide Formula: C13H22BrNO MolecularWeight: 288.22388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[N+](C)(C)CCCO.[Br-]

Isomeric SMILES

CC1=CC=CC=C1C[N+](C)(C)CCCO.[Br-]

InChI

InChI=1S/C13H22NO.BrH/c1-12-7-4-5-8-13(12)11-14(2,3)9-6-10-15;/h4-5,7-8,15H,6,9-11H2,1-3H3;1H/q+1;/p-1