(2-chloranyl-4-fluoranyl-phenyl)methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Openeye Name: (2-chloro-4-fluoro-phenyl)methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]ammonium CAS Name: (2-chloro-4-fluorophenyl)methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]ammonium IUPAC Name: (2-chloro-4-fluorophenyl)methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Traditional Name: (2-chloro-4-fluoro-benzyl)-[(1S)-1-(4-mesylphenyl)ethyl]-methyl-ammonium Formula: C17H20ClFNO2S+ MolecularWeight: 356.862603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)[NH+](C)CC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)S(=O)(=O)C)[NH+](C)CC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C17H19ClFNO2S/c1-12(13-5-8-16(9-6-13)23(3,21)22)20(2)11-14-4-7-15(19)10-17(14)18/h4-10,12H,11H2,1-3H3/p+1/t12-/m0/s1