[(2S)-2-[2-(3-bromanylphenoxy)ethanoylamino]-2-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(2S)-2-[2-(3-bromanylphenoxy)ethanoylamino]-2-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(2S)-2-[[2-(3-bromophenoxy)acetyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(2S)-2-[[2-(3-bromophenoxy)-1-oxoethyl]amino]-2-phenylethyl]-dimethylammonium IUPAC Name: [(2S)-2-[[2-(3-bromophenoxy)acetyl]amino]-2-phenylethyl]-dimethylazanium Traditional Name: [(2S)-2-[[2-(3-bromophenoxy)acetyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium Formula: C18H22BrN2O2+ MolecularWeight: 378.28348

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(C1=CC=CC=C1)NC(=O)COC2=CC(=CC=C2)Br

Isomeric SMILES

C[NH+](C)C[C@H](C1=CC=CC=C1)NC(=O)COC2=CC(=CC=C2)Br

InChI

InChI=1S/C18H21BrN2O2/c1-21(2)12-17(14-7-4-3-5-8-14)20-18(22)13-23-16-10-6-9-15(19)11-16/h3-11,17H,12-13H2,1-2H3,(H,20,22)/p+1/t17-/m1/s1