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

Systemtic Name: 4-bromanyl-3-[(E)-but-2-enyl]sulfonyl-benzoic acid Openeye Name: 4-bromo-3-[(E)-but-2-enyl]sulfonyl-benzoic acid CAS Name: 4-bromo-3-[(E)-but-2-enyl]sulfonylbenzoic acid IUPAC Name: 4-bromo-3-[(E)-but-2-enyl]sulfonylbenzoic acid Traditional Name: 4-bromo-3-[(E)-but-2-enyl]sulfonyl-benzoic acid Formula: C11H11BrO4S MolecularWeight: 319.17164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11BrO4S/c1-2-3-6-17(15,16)10-7-8(11(13)14)4-5-9(10)12/h2-5,7H,6H2,1H3,(H,13,14)/b3-2+