3-[4-[bis(bromanyl)methylsulfonyl]phenoxy]propane-1-sulfonic acid

Systemtic Name: 3-[4-[bis(bromanyl)methylsulfonyl]phenoxy]propane-1-sulfonic acid Openeye Name: 3-[4-(dibromomethylsulfonyl)phenoxy]propane-1-sulfonic acid CAS Name: 3-[4-(dibromomethylsulfonyl)phenoxy]-1-propanesulfonic acid IUPAC Name: 3-[4-(dibromomethylsulfonyl)phenoxy]propane-1-sulfonic acid Traditional Name: 3-[4-(dibromomethylsulfonyl)phenoxy]propane-1-sulfonic acid Formula: C10H12Br2O6S2 MolecularWeight: 452.13668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCS(=O)(=O)O)S(=O)(=O)C(Br)Br

Isomeric SMILES

C1=CC(=CC=C1OCCCS(=O)(=O)O)S(=O)(=O)C(Br)Br

InChI

InChI=1S/C10H12Br2O6S2/c11-10(12)20(16,17)9-4-2-8(3-5-9)18-6-1-7-19(13,14)15/h2-5,10H,1,6-7H2,(H,13,14,15)