2-[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]sulfanylbenzoate

Systemtic Name: 2-[(2S)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]sulfanylbenzoate Openeye Name: 2-[(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]sulfanylbenzoate CAS Name: 2-[[(2S)-1-oxo-1-(1-piperidinyl)propan-2-yl]thio]benzoate IUPAC Name: 2-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]sulfanylbenzoate Traditional Name: 2-[[(1S)-2-keto-1-methyl-2-piperidino-ethyl]thio]benzoate Formula: C15H18NO3S- MolecularWeight: 292.37332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1)SC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)N1CCCCC1)SC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C15H19NO3S/c1-11(14(17)16-9-5-2-6-10-16)20-13-8-4-3-7-12(13)15(18)19/h3-4,7-8,11H,2,5-6,9-10H2,1H3,(H,18,19)/p-1/t11-/m0/s1