2,2,2-tris(bromanyl)ethyl 4-nitrobenzenesulfonate

Systemtic Name: 2,2,2-tris(bromanyl)ethyl 4-nitrobenzenesulfonate Openeye Name: 2,2,2-tribromoethyl 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid 2,2,2-tribromoethyl ester IUPAC Name: 2,2,2-tribromoethyl 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid 2,2,2-tribromoethyl ester Formula: C8H6Br3NO5S MolecularWeight: 467.91394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)OCC(Br)(Br)Br

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)OCC(Br)(Br)Br

InChI

InChI=1S/C8H6Br3NO5S/c9-8(10,11)5-17-18(15,16)7-3-1-6(2-4-7)12(13)14/h1-4H,5H2