3-(4-bromanyl-2,6-dimethyl-phenoxy)propyl-dimethyl-azanium

Systemtic Name: 3-(4-bromanyl-2,6-dimethyl-phenoxy)propyl-dimethyl-azanium Openeye Name: 3-(4-bromo-2,6-dimethyl-phenoxy)propyl-dimethyl-ammonium CAS Name: 3-(4-bromo-2,6-dimethylphenoxy)propyl-dimethylammonium IUPAC Name: 3-(4-bromo-2,6-dimethylphenoxy)propyl-dimethylazanium Traditional Name: 3-(4-bromo-2,6-dimethyl-phenoxy)propyl-dimethyl-ammonium Formula: C13H21BrNO+ MolecularWeight: 287.21594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCC[NH+](C)C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCCC[NH+](C)C)C)Br

InChI

InChI=1S/C13H20BrNO/c1-10-8-12(14)9-11(2)13(10)16-7-5-6-15(3)4/h8-9H,5-7H2,1-4H3/p+1