3-[(E)-but-2-enyl]sulfonyl-4,5-dimethyl-benzoic acid

Systemtic Name: 3-[(E)-but-2-enyl]sulfonyl-4,5-dimethyl-benzoic acid Openeye Name: 3-[(E)-but-2-enyl]sulfonyl-4,5-dimethyl-benzoic acid CAS Name: 3-[(E)-but-2-enyl]sulfonyl-4,5-dimethylbenzoic acid IUPAC Name: 3-[(E)-but-2-enyl]sulfonyl-4,5-dimethylbenzoic acid Traditional Name: 3-[(E)-but-2-enyl]sulfonyl-4,5-dimethyl-benzoic acid Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCS(=O)(=O)C1=CC(=CC(=C1C)C)C(=O)O

Isomeric SMILES

C/C=C/CS(=O)(=O)C1=CC(=CC(=C1C)C)C(=O)O

InChI

InChI=1S/C13H16O4S/c1-4-5-6-18(16,17)12-8-11(13(14)15)7-9(2)10(12)3/h4-5,7-8H,6H2,1-3H3,(H,14,15)/b5-4+