1-[2,4,5-tris(chloranyl)phenyl]sulfonyl-1,4-diazepan-4-ium

Systemtic Name: 1-[2,4,5-tris(chloranyl)phenyl]sulfonyl-1,4-diazepan-4-ium Openeye Name: 1-(2,4,5-trichlorophenyl)sulfonyl-1,4-diazepan-4-ium CAS Name: 1-(2,4,5-trichlorophenyl)sulfonyl-1,4-diazepan-4-ium IUPAC Name: 1-(2,4,5-trichlorophenyl)sulfonyl-1,4-diazepan-4-ium Traditional Name: 1-(2,4,5-trichlorophenyl)sulfonyl-1,4-diazepan-4-ium Formula: C11H14Cl3N2O2S+ MolecularWeight: 344.66506

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)S(=O)(=O)C2=CC(=C(C=C2Cl)Cl)Cl

Isomeric SMILES

C1C[NH2+]CCN(C1)S(=O)(=O)C2=CC(=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C11H13Cl3N2O2S/c12-8-6-10(14)11(7-9(8)13)19(17,18)16-4-1-2-15-3-5-16/h6-7,15H,1-5H2/p+1