[(2S)-1-pyridin-1-ium-1-ylpropan-2-yl] sulfate

Systemtic Name: [(2S)-1-pyridin-1-ium-1-ylpropan-2-yl] sulfate Openeye Name: [(1S)-1-methyl-2-pyridin-1-ium-1-yl-ethyl] sulfate CAS Name: [(2S)-1-(1-pyridin-1-iumyl)propan-2-yl] sulfate IUPAC Name: [(2S)-1-pyridin-1-ium-1-ylpropan-2-yl] sulfate Traditional Name: [(1S)-1-methyl-2-pyridin-1-ium-1-yl-ethyl] sulfate Formula: C8H11NO4S MolecularWeight: 217.24224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[N+]1=CC=CC=C1)OS(=O)(=O)[O-]

Isomeric SMILES

C[C@@H](C[N+]1=CC=CC=C1)OS(=O)(=O)[O-]

InChI

InChI=1S/C8H11NO4S/c1-8(13-14(10,11)12)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3/t8-/m0/s1