[(2S)-butan-2-yl]-[[4-(4-fluorophenyl)sulfonyloxyphenyl]methyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[[4-(4-fluorophenyl)sulfonyloxyphenyl]methyl]azanium Openeye Name: [4-(4-fluorophenyl)sulfonyloxyphenyl]methyl-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[[4-(4-fluorophenyl)sulfonyloxyphenyl]methyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[[4-(4-fluorophenyl)sulfonyloxyphenyl]methyl]azanium Traditional Name: [4-(4-fluorophenyl)sulfonyloxybenzyl]-[(1S)-1-methylpropyl]ammonium Formula: C17H21FNO3S+ MolecularWeight: 338.416943

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC[C@H](C)[NH2+]CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H20FNO3S/c1-3-13(2)19-12-14-4-8-16(9-5-14)22-23(20,21)17-10-6-15(18)7-11-17/h4-11,13,19H,3,12H2,1-2H3/p+1/t13-/m0/s1