4-(3-bromanylpropoxy)-2-butyl-benzenesulfinic acid

Systemtic Name: 4-(3-bromanylpropoxy)-2-butyl-benzenesulfinic acid Openeye Name: 4-(3-bromopropoxy)-2-butyl-benzenesulfinic acid CAS Name: 4-(3-bromopropoxy)-2-butylbenzenesulfinic acid IUPAC Name: 4-(3-bromopropoxy)-2-butylbenzenesulfinic acid Traditional Name: 4-(3-bromopropoxy)-2-butyl-benzenesulfinic acid Formula: C13H19BrO3S MolecularWeight: 335.25716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)OCCCBr)S(=O)O

Isomeric SMILES

CCCCC1=C(C=CC(=C1)OCCCBr)S(=O)O

InChI

InChI=1S/C13H19BrO3S/c1-2-3-5-11-10-12(17-9-4-8-14)6-7-13(11)18(15)16/h6-7,10H,2-5,8-9H2,1H3,(H,15,16)