2-bromanyl-3-prop-1-en-2-yl-benzenesulfonic acid

Systemtic Name: 2-bromanyl-3-prop-1-en-2-yl-benzenesulfonic acid Openeye Name: 2-bromo-3-isopropenyl-benzenesulfonic acid CAS Name: 2-bromo-3-(1-methylethenyl)benzenesulfonic acid IUPAC Name: 2-bromo-3-prop-1-en-2-ylbenzenesulfonic acid Traditional Name: 2-bromo-3-isopropenyl-besylic acid Formula: C9H9BrO3S MolecularWeight: 277.13496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9BrO3S/c1-6(2)7-4-3-5-8(9(7)10)14(11,12)13/h3-5H,1H2,2H3,(H,11,12,13)