4-chloranyl-3-[(E)-3-chloranylprop-2-enyl]sulfonyl-benzoic acid

Systemtic Name: 4-chloranyl-3-[(E)-3-chloranylprop-2-enyl]sulfonyl-benzoic acid Openeye Name: 4-chloro-3-[(E)-3-chloroallyl]sulfonyl-benzoic acid CAS Name: 4-chloro-3-[(E)-3-chloroprop-2-enyl]sulfonylbenzoic acid IUPAC Name: 4-chloro-3-[(E)-3-chloroprop-2-enyl]sulfonylbenzoic acid Traditional Name: 4-chloro-3-[(E)-3-chloroallyl]sulfonyl-benzoic acid Formula: C10H8Cl2O4S MolecularWeight: 295.13912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)S(=O)(=O)CC=CCl)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)S(=O)(=O)C/C=C/Cl)Cl

InChI

InChI=1S/C10H8Cl2O4S/c11-4-1-5-17(15,16)9-6-7(10(13)14)2-3-8(9)12/h1-4,6H,5H2,(H,13,14)/b4-1+