2-[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl]sulfonylbenzoate

Systemtic Name: 2-[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl]sulfonylbenzoate Openeye Name: 2-[2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethyl]sulfonylbenzoate CAS Name: 2-[2-[[(2S)-butan-2-yl]amino]-2-oxoethyl]sulfonylbenzoate IUPAC Name: 2-[2-[[(2S)-butan-2-yl]amino]-2-oxoethyl]sulfonylbenzoate Traditional Name: 2-[2-keto-2-[[(1S)-1-methylpropyl]amino]ethyl]sulfonylbenzoate Formula: C13H16NO5S- MolecularWeight: 298.33484

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CS(=O)(=O)C1=CC=CC=C1C(=O)[O-]

Isomeric SMILES

CC[C@H](C)NC(=O)CS(=O)(=O)C1=CC=CC=C1C(=O)[O-]

InChI

InChI=1S/C13H17NO5S/c1-3-9(2)14-12(15)8-20(18,19)11-7-5-4-6-10(11)13(16)17/h4-7,9H,3,8H2,1-2H3,(H,14,15)(H,16,17)/p-1/t9-/m0/s1