[(1R)-2-[2-(4-cyanophenoxy)ethanoylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[2-(4-cyanophenoxy)ethanoylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[[2-(4-cyanophenoxy)acetyl]amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[2-(4-cyanophenoxy)-1-oxoethyl]amino]-1-thiophen-2-ylethyl]-dimethylammonium IUPAC Name: [(1R)-2-[[2-(4-cyanophenoxy)acetyl]amino]-1-thiophen-2-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[[2-(4-cyanophenoxy)acetyl]amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C17H20N3O2S+ MolecularWeight: 330.4246

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)COC1=CC=C(C=C1)C#N)C2=CC=CS2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)COC1=CC=C(C=C1)C#N)C2=CC=CS2

InChI

InChI=1S/C17H19N3O2S/c1-20(2)15(16-4-3-9-23-16)11-19-17(21)12-22-14-7-5-13(10-18)6-8-14/h3-9,15H,11-12H2,1-2H3,(H,19,21)/p+1/t15-/m1/s1