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

Systemtic Name: 3-[(E)-but-2-enyl]sulfonyl-4-methoxy-benzoic acid Openeye Name: 3-[(E)-but-2-enyl]sulfonyl-4-methoxy-benzoic acid CAS Name: 3-[(E)-but-2-enyl]sulfonyl-4-methoxybenzoic acid IUPAC Name: 3-[(E)-but-2-enyl]sulfonyl-4-methoxybenzoic acid Traditional Name: 3-[(E)-but-2-enyl]sulfonyl-4-methoxy-benzoic acid Formula: C12H14O5S MolecularWeight: 270.30156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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