3-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]propyl-dimethyl-azanium Openeye Name: 3-[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]propyl-dimethyl-ammonium Formula: C15H24BrN2O2+ MolecularWeight: 344.26726

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NCCC[NH+](C)C)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NCCC[NH+](C)C)Br

InChI

InChI=1S/C15H23BrN2O2/c1-4-12-6-7-14(13(16)10-12)20-11-15(19)17-8-5-9-18(2)3/h6-7,10H,4-5,8-9,11H2,1-3H3,(H,17,19)/p+1