1-(2-bromophenyl)-1-(4-nitrophenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-(2-bromophenyl)-1-(4-nitrophenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-(2-bromophenyl)-1-(4-nitrophenyl)sulfonyl-piperazin-1-ium CAS Name: 1-(2-bromophenyl)-1-(4-nitrophenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-(2-bromophenyl)-1-(4-nitrophenyl)sulfonylpiperazin-1-ium Traditional Name: 1-(2-bromophenyl)-1-nosyl-piperazin-1-ium Formula: C16H17BrN3O4S+ MolecularWeight: 427.29288

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1)(C2=CC=CC=C2Br)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C[N+](CCN1)(C2=CC=CC=C2Br)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H17BrN3O4S/c17-15-3-1-2-4-16(15)20(11-9-18-10-12-20)25(23,24)14-7-5-13(6-8-14)19(21)22/h1-8,18H,9-12H2/q+1