trimethyl-[2-[[3-[tris(bromanyl)methylsulfonyl]phenyl]carbonylamino]ethyl]azanium

Systemtic Name: trimethyl-[2-[[3-[tris(bromanyl)methylsulfonyl]phenyl]carbonylamino]ethyl]azanium Openeye Name: trimethyl-[2-[[3-(tribromomethylsulfonyl)benzoyl]amino]ethyl]ammonium CAS Name: trimethyl-[2-[[oxo-[3-(tribromomethylsulfonyl)phenyl]methyl]amino]ethyl]ammonium IUPAC Name: trimethyl-[2-[[3-(tribromomethylsulfonyl)benzoyl]amino]ethyl]azanium Traditional Name: trimethyl-[2-[[3-(tribromomethylsulfonyl)benzoyl]amino]ethyl]ammonium Formula: C13H18Br3N2O3S+ MolecularWeight: 522.07062

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCNC(=O)C1=CC(=CC=C1)S(=O)(=O)C(Br)(Br)Br

Isomeric SMILES

C[N+](C)(C)CCNC(=O)C1=CC(=CC=C1)S(=O)(=O)C(Br)(Br)Br

InChI

InChI=1S/C13H17Br3N2O3S/c1-18(2,3)8-7-17-12(19)10-5-4-6-11(9-10)22(20,21)13(14,15)16/h4-6,9H,7-8H2,1-3H3/p+1