5-[(E)-but-2-enyl]sulfonyl-2-methoxy-benzoic acid

Systemtic Name: 5-[(E)-but-2-enyl]sulfonyl-2-methoxy-benzoic acid Openeye Name: 5-[(E)-but-2-enyl]sulfonyl-2-methoxy-benzoic acid CAS Name: 5-[(E)-but-2-enyl]sulfonyl-2-methoxybenzoic acid IUPAC Name: 5-[(E)-but-2-enyl]sulfonyl-2-methoxybenzoic acid Traditional Name: 5-[(E)-but-2-enyl]sulfonyl-2-methoxy-benzoic acid Formula: C12H14O5S MolecularWeight: 270.30156

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCS(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)O

Isomeric SMILES

C/C=C/CS(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)O

InChI

InChI=1S/C12H14O5S/c1-3-4-7-18(15,16)9-5-6-11(17-2)10(8-9)12(13)14/h3-6,8H,7H2,1-2H3,(H,13,14)/b4-3+