[(3S)-3-[3,4-bis(fluoranyl)phenoxy]-3-thiophen-2-yl-propyl]azanium

Systemtic Name: [(3S)-3-[3,4-bis(fluoranyl)phenoxy]-3-thiophen-2-yl-propyl]azanium Openeye Name: [(3S)-3-(3,4-difluorophenoxy)-3-(2-thienyl)propyl]ammonium CAS Name: [(3S)-3-(3,4-difluorophenoxy)-3-thiophen-2-ylpropyl]ammonium IUPAC Name: [(3S)-3-(3,4-difluorophenoxy)-3-thiophen-2-ylpropyl]azanium Traditional Name: [(3S)-3-(3,4-difluorophenoxy)-3-(2-thienyl)propyl]ammonium Formula: C13H14F2NOS+ MolecularWeight: 270.318166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(CC[NH3+])OC2=CC(=C(C=C2)F)F

Isomeric SMILES

C1=CSC(=C1)[C@H](CC[NH3+])OC2=CC(=C(C=C2)F)F

InChI

InChI=1S/C13H13F2NOS/c14-10-4-3-9(8-11(10)15)17-12(5-6-16)13-2-1-7-18-13/h1-4,7-8,12H,5-6,16H2/p+1/t12-/m0/s1