2-(2-chloroethylsulfanyl)-3-methyl-3-oxidanyl-butanoate

Systemtic Name: 2-(2-chloroethylsulfanyl)-3-methyl-3-oxidanyl-butanoate Openeye Name: 2-(2-chloroethylsulfanyl)-3-hydroxy-3-methyl-butanoate CAS Name: 2-(2-chloroethylthio)-3-hydroxy-3-methylbutanoate IUPAC Name: 2-(2-chloroethylsulfanyl)-3-hydroxy-3-methylbutanoate Traditional Name: 2-(2-chloroethylthio)-3-hydroxy-3-methyl-butyrate Formula: C7H12ClO3S- MolecularWeight: 211.68638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)[O-])SCCCl)O

Isomeric SMILES

CC(C)(C(C(=O)[O-])SCCCl)O

InChI

InChI=1S/C7H13ClO3S/c1-7(2,11)5(6(9)10)12-4-3-8/h5,11H,3-4H2,1-2H3,(H,9,10)/p-1