3-[4-(2-chloranylprop-2-enylsulfonyl)phenyl]propanoic acid

Systemtic Name: 3-[4-(2-chloranylprop-2-enylsulfonyl)phenyl]propanoic acid Openeye Name: 3-[4-(2-chloroallylsulfonyl)phenyl]propanoic acid CAS Name: 3-[4-(2-chloroprop-2-enylsulfonyl)phenyl]propanoic acid IUPAC Name: 3-[4-(2-chloroprop-2-enylsulfonyl)phenyl]propanoic acid Traditional Name: 3-[4-(2-chloroallylsulfonyl)phenyl]propionic acid Formula: C12H13ClO4S MolecularWeight: 288.74722

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CS(=O)(=O)C1=CC=C(C=C1)CCC(=O)O)Cl

Isomeric SMILES

C=C(CS(=O)(=O)C1=CC=C(C=C1)CCC(=O)O)Cl

InChI

InChI=1S/C12H13ClO4S/c1-9(13)8-18(16,17)11-5-2-10(3-6-11)4-7-12(14)15/h2-3,5-6H,1,4,7-8H2,(H,14,15)