2-(4-bromanylbutyl)-4-methyl-benzenesulfonic acid

Systemtic Name: 2-(4-bromanylbutyl)-4-methyl-benzenesulfonic acid Openeye Name: 2-(4-bromobutyl)-4-methyl-benzenesulfonic acid CAS Name: 2-(4-bromobutyl)-4-methylbenzenesulfonic acid IUPAC Name: 2-(4-bromobutyl)-4-methylbenzenesulfonic acid Traditional Name: 2-(4-bromobutyl)-4-methyl-besylic acid Formula: C11H15BrO3S MolecularWeight: 307.204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)O)CCCCBr

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)O)CCCCBr

InChI

InChI=1S/C11H15BrO3S/c1-9-5-6-11(16(13,14)15)10(8-9)4-2-3-7-12/h5-6,8H,2-4,7H2,1H3,(H,13,14,15)