[(1S)-2-azaniumyl-1-thiophen-3-yl-ethyl]-[(3-fluorophenyl)methyl]-methyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-thiophen-3-yl-ethyl]-[(3-fluorophenyl)methyl]-methyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(3-thienyl)ethyl]-[(3-fluorophenyl)methyl]-methyl-ammonium CAS Name: [(1S)-2-ammonio-1-(3-thiophenyl)ethyl]-[(3-fluorophenyl)methyl]-methylammonium IUPAC Name: [(1S)-2-azaniumyl-1-thiophen-3-ylethyl]-[(3-fluorophenyl)methyl]-methylazanium Traditional Name: [(1S)-2-ammonio-1-(3-thienyl)ethyl]-(3-fluorobenzyl)-methyl-ammonium Formula: C14H19FN2S+2 MolecularWeight: 266.377463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)F)C(C[NH3+])C2=CSC=C2

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)F)[C@H](C[NH3+])C2=CSC=C2

InChI

InChI=1S/C14H17FN2S/c1-17(9-11-3-2-4-13(15)7-11)14(8-16)12-5-6-18-10-12/h2-7,10,14H,8-9,16H2,1H3/p+2/t14-/m1/s1