(3-fluorophenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium

Systemtic Name: (3-fluorophenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Openeye Name: (3-fluorophenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]ammonium CAS Name: (3-fluorophenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]ammonium IUPAC Name: (3-fluorophenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Traditional Name: (3-fluorobenzyl)-[(1S)-1-(4-mesylphenyl)ethyl]ammonium Formula: C16H19FNO2S+ MolecularWeight: 308.390963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)[NH2+]CC2=CC(=CC=C2)F

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)S(=O)(=O)C)[NH2+]CC2=CC(=CC=C2)F

InChI

InChI=1S/C16H18FNO2S/c1-12(18-11-13-4-3-5-15(17)10-13)14-6-8-16(9-7-14)21(2,19)20/h3-10,12,18H,11H2,1-2H3/p+1/t12-/m0/s1