[4-[tris(bromanyl)methylsulfonyl]phenyl] 4-methoxybenzenesulfinate

Systemtic Name: [4-[tris(bromanyl)methylsulfonyl]phenyl] 4-methoxybenzenesulfinate Openeye Name: [4-(tribromomethylsulfonyl)phenyl] 4-methoxybenzenesulfinate CAS Name: 4-methoxybenzenesulfinic acid [4-(tribromomethylsulfonyl)phenyl] ester IUPAC Name: [4-(tribromomethylsulfonyl)phenyl] 4-methoxybenzenesulfinate Traditional Name: 4-methoxybenzenesulfinic acid [4-(tribromomethylsulfonyl)phenyl] ester Formula: C14H11Br3O5S2 MolecularWeight: 563.07614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)OC2=CC=C(C=C2)S(=O)(=O)C(Br)(Br)Br

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)OC2=CC=C(C=C2)S(=O)(=O)C(Br)(Br)Br

InChI

InChI=1S/C14H11Br3O5S2/c1-21-10-2-6-12(7-3-10)23(18)22-11-4-8-13(9-5-11)24(19,20)14(15,16)17/h2-9H,1H3