2-[(2S)-butan-2-yl]sulfanylbenzoate

Systemtic Name: 2-[(2S)-butan-2-yl]sulfanylbenzoate Openeye Name: 2-[(1S)-1-methylpropyl]sulfanylbenzoate CAS Name: 2-[[(2S)-butan-2-yl]thio]benzoate IUPAC Name: 2-[(2S)-butan-2-yl]sulfanylbenzoate Traditional Name: 2-[[(1S)-1-methylpropyl]thio]benzoate Formula: C11H13O2S- MolecularWeight: 209.28472

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=CC=CC=C1C(=O)[O-]

Isomeric SMILES

CC[C@H](C)SC1=CC=CC=C1C(=O)[O-]

InChI

InChI=1S/C11H14O2S/c1-3-8(2)14-10-7-5-4-6-9(10)11(12)13/h4-8H,3H2,1-2H3,(H,12,13)/p-1/t8-/m0/s1