[(1S)-2-[2-(2-fluoranylphenoxy)ethanoylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[2-(2-fluoranylphenoxy)ethanoylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[[2-(2-fluorophenoxy)acetyl]amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[2-(2-fluorophenoxy)-1-oxoethyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[[2-(2-fluorophenoxy)acetyl]amino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1S)-2-[[2-(2-fluorophenoxy)acetyl]amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C16H20FN2O2S+ MolecularWeight: 323.405603

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)COC1=CC=CC=C1F)C2=CSC=C2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)COC1=CC=CC=C1F)C2=CSC=C2

InChI

InChI=1S/C16H19FN2O2S/c1-19(2)14(12-7-8-22-11-12)9-18-16(20)10-21-15-6-4-3-5-13(15)17/h3-8,11,14H,9-10H2,1-2H3,(H,18,20)/p+1/t14-/m1/s1