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

Systemtic Name: 3-[(E)-3-chloranylprop-2-enyl]sulfonyl-4-methoxy-benzoic acid Openeye Name: 3-[(E)-3-chloroallyl]sulfonyl-4-methoxy-benzoic acid CAS Name: 3-[(E)-3-chloroprop-2-enyl]sulfonyl-4-methoxybenzoic acid IUPAC Name: 3-[(E)-3-chloroprop-2-enyl]sulfonyl-4-methoxybenzoic acid Traditional Name: 3-[(E)-3-chloroallyl]sulfonyl-4-methoxy-benzoic acid Formula: C11H11ClO5S MolecularWeight: 290.72004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)CC=CCl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)C/C=C/Cl

InChI

InChI=1S/C11H11ClO5S/c1-17-9-4-3-8(11(13)14)7-10(9)18(15,16)6-2-5-12/h2-5,7H,6H2,1H3,(H,13,14)/b5-2+