4-[2,3-bis(2-bromoethylsulfanyl)propoxy]benzoic acid

Systemtic Name: 4-[2,3-bis(2-bromoethylsulfanyl)propoxy]benzoic acid Openeye Name: 4-[2,3-bis(2-bromoethylsulfanyl)propoxy]benzoic acid CAS Name: 4-[2,3-bis(2-bromoethylthio)propoxy]benzoic acid IUPAC Name: 4-[2,3-bis(2-bromoethylsulfanyl)propoxy]benzoic acid Traditional Name: 4-[2,3-bis(2-bromoethylthio)propoxy]benzoic acid Formula: C14H18Br2O3S2 MolecularWeight: 458.22892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)OCC(CSCCBr)SCCBr

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)OCC(CSCCBr)SCCBr

InChI

InChI=1S/C14H18Br2O3S2/c15-5-7-20-10-13(21-8-6-16)9-19-12-3-1-11(2-4-12)14(17)18/h1-4,13H,5-10H2,(H,17,18)