4-[(E)-3-chloranylprop-2-enyl]sulfonylbenzoic acid

Systemtic Name: 4-[(E)-3-chloranylprop-2-enyl]sulfonylbenzoic acid Openeye Name: 4-[(E)-3-chloroallyl]sulfonylbenzoic acid CAS Name: 4-[(E)-3-chloroprop-2-enyl]sulfonylbenzoic acid IUPAC Name: 4-[(E)-3-chloroprop-2-enyl]sulfonylbenzoic acid Traditional Name: 4-[(E)-3-chloroallyl]sulfonylbenzoic acid Formula: C10H9ClO4S MolecularWeight: 260.69406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9ClO4S/c11-6-1-7-16(14,15)9-4-2-8(3-5-9)10(12)13/h1-6H,7H2,(H,12,13)/b6-1+