[(2S)-3-methyl-2-(phenylsulfonylmethyl)butyl] 2-chloranylethanoate

Systemtic Name: [(2S)-3-methyl-2-(phenylsulfonylmethyl)butyl] 2-chloranylethanoate Openeye Name: [(2S)-2-(benzenesulfonylmethyl)-3-methyl-butyl] 2-chloroacetate CAS Name: 2-chloroacetic acid [(2S)-2-(benzenesulfonylmethyl)-3-methylbutyl] ester IUPAC Name: [(2S)-2-(benzenesulfonylmethyl)-3-methylbutyl] 2-chloroacetate Traditional Name: 2-chloroacetic acid [(2S)-2-(besylmethyl)-3-methyl-butyl] ester Formula: C14H19ClO4S MolecularWeight: 318.81626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(COC(=O)CCl)CS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C)[C@@H](COC(=O)CCl)CS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C14H19ClO4S/c1-11(2)12(9-19-14(16)8-15)10-20(17,18)13-6-4-3-5-7-13/h3-7,11-12H,8-10H2,1-2H3/t12-/m0/s1