[(2S)-2-[2-(2-bromanyl-4-chloranyl-phenoxy)ethanoylamino]-2-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(2S)-2-[2-(2-bromanyl-4-chloranyl-phenoxy)ethanoylamino]-2-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(2S)-2-[[2-(2-bromo-4-chloro-phenoxy)acetyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(2S)-2-[[2-(2-bromo-4-chlorophenoxy)-1-oxoethyl]amino]-2-phenylethyl]-dimethylammonium IUPAC Name: [(2S)-2-[[2-(2-bromo-4-chlorophenoxy)acetyl]amino]-2-phenylethyl]-dimethylazanium Traditional Name: [(2S)-2-[[2-(2-bromo-4-chloro-phenoxy)acetyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium Formula: C18H21BrClN2O2+ MolecularWeight: 412.72854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20BrClN2O2/c1-22(2)11-16(13-6-4-3-5-7-13)21-18(23)12-24-17-9-8-14(20)10-15(17)19/h3-10,16H,11-12H2,1-2H3,(H,21,23)/p+1/t16-/m1/s1