1-(4-bromanyl-2-chloranyl-phenyl)sulfonyl-4-[(6-chloranylpyridin-3-yl)methyl]piperazin-4-ium

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)sulfonyl-4-[(6-chloranylpyridin-3-yl)methyl]piperazin-4-ium Openeye Name: 1-(4-bromo-2-chloro-phenyl)sulfonyl-4-[(6-chloro-3-pyridyl)methyl]piperazin-4-ium CAS Name: 1-(4-bromo-2-chlorophenyl)sulfonyl-4-[(6-chloro-3-pyridinyl)methyl]piperazin-4-ium IUPAC Name: 1-(4-bromo-2-chlorophenyl)sulfonyl-4-[(6-chloropyridin-3-yl)methyl]piperazin-4-ium Traditional Name: 1-(4-bromo-2-chloro-phenyl)sulfonyl-4-[(6-chloro-3-pyridyl)methyl]piperazin-4-ium Formula: C16H17BrCl2N3O2S+ MolecularWeight: 466.20008

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CN=C(C=C2)Cl)S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CN=C(C=C2)Cl)S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C16H16BrCl2N3O2S/c17-13-2-3-15(14(18)9-13)25(23,24)22-7-5-21(6-8-22)11-12-1-4-16(19)20-10-12/h1-4,9-10H,5-8,11H2/p+1