2-[(E)-2-chloranyl-3-oxidanyl-prop-1-enyl]sulfanylethanoate

Systemtic Name: 2-[(E)-2-chloranyl-3-oxidanyl-prop-1-enyl]sulfanylethanoate Openeye Name: 2-[(E)-2-chloro-3-hydroxy-prop-1-enyl]sulfanylacetate CAS Name: 2-[[(E)-2-chloro-3-hydroxyprop-1-enyl]thio]acetate IUPAC Name: 2-[(E)-2-chloro-3-hydroxyprop-1-enyl]sulfanylacetate Traditional Name: 2-[[(E)-2-chloro-3-hydroxy-prop-1-enyl]thio]acetate Formula: C5H6ClO3S- MolecularWeight: 181.61734

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=CSCC(=O)[O-])Cl)O

Isomeric SMILES

C(/C(=C\SCC(=O)[O-])/Cl)O

InChI

InChI=1S/C5H7ClO3S/c6-4(1-7)2-10-3-5(8)9/h2,7H,1,3H2,(H,8,9)/p-1/b4-2+