[(1S)-2-[2-(4-bromanyl-2-chloranyl-phenoxy)ethanoylamino]-1-phenyl-ethyl]-dimethyl-azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)COC1=C(C=C(C=C1)Br)Cl)C2=CC=CC=C2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)COC1=C(C=C(C=C1)Br)Cl)C2=CC=CC=C2

InChI

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