(2-chloranyl-4-fluoranyl-phenyl)methyl-ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl-ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium Openeye Name: (2-chloro-4-fluoro-phenyl)methyl-ethyl-[2-oxo-2-(2-thienylmethylamino)ethyl]ammonium CAS Name: (2-chloro-4-fluorophenyl)methyl-ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]ammonium IUPAC Name: (2-chloro-4-fluorophenyl)methyl-ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]azanium Traditional Name: (2-chloro-4-fluoro-benzyl)-ethyl-[2-keto-2-(2-thenylamino)ethyl]ammonium Formula: C16H19ClFN2OS+ MolecularWeight: 341.851263

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=C(C=C(C=C1)F)Cl)CC(=O)NCC2=CC=CS2

Isomeric SMILES

CC[NH+](CC1=C(C=C(C=C1)F)Cl)CC(=O)NCC2=CC=CS2

InChI

InChI=1S/C16H18ClFN2OS/c1-2-20(10-12-5-6-13(18)8-15(12)17)11-16(21)19-9-14-4-3-7-22-14/h3-8H,2,9-11H2,1H3,(H,19,21)/p+1