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

Systemtic Name: 3-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)propyl-dimethyl-azanium Openeye Name: 3-(2-bromo-6-chloro-4-methyl-phenoxy)propyl-dimethyl-ammonium CAS Name: 3-(2-bromo-6-chloro-4-methylphenoxy)propyl-dimethylammonium IUPAC Name: 3-(2-bromo-6-chloro-4-methylphenoxy)propyl-dimethylazanium Traditional Name: 3-(2-bromo-6-chloro-4-methyl-phenoxy)propyl-dimethyl-ammonium Formula: C12H18BrClNO+ MolecularWeight: 307.63442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCC[NH+](C)C)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCC[NH+](C)C)Cl

InChI

InChI=1S/C12H17BrClNO/c1-9-7-10(13)12(11(14)8-9)16-6-4-5-15(2)3/h7-8H,4-6H2,1-3H3/p+1