4-(4-bromanyl-2,3-dimethyl-phenoxy)butyl-diethyl-azanium

Systemtic Name: 4-(4-bromanyl-2,3-dimethyl-phenoxy)butyl-diethyl-azanium Openeye Name: 4-(4-bromo-2,3-dimethyl-phenoxy)butyl-diethyl-ammonium CAS Name: 4-(4-bromo-2,3-dimethylphenoxy)butyl-diethylammonium IUPAC Name: 4-(4-bromo-2,3-dimethylphenoxy)butyl-diethylazanium Traditional Name: 4-(4-bromo-2,3-dimethyl-phenoxy)butyl-diethyl-ammonium Formula: C16H27BrNO+ MolecularWeight: 329.29568

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCCOC1=C(C(=C(C=C1)Br)C)C

Isomeric SMILES

CC[NH+](CC)CCCCOC1=C(C(=C(C=C1)Br)C)C

InChI

InChI=1S/C16H26BrNO/c1-5-18(6-2)11-7-8-12-19-16-10-9-15(17)13(3)14(16)4/h9-10H,5-8,11-12H2,1-4H3/p+1